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Chemistry

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Also known as: Nurtec odt, Rimegepant sulfate [usan], 1374024-48-2, 1383nm3q0h, Rimegepant sulfate (usan), 1-piperidinecarboxylic acid, 4-(2,3-dihydro-2-oxo-1h-imidazo(4,5-b)pyridin-1-yl)-, (5s,6s,9r)-5-amino-6-(2,3-difluorophenyl)-6,7,8,9-tetrahydro-5h-cyclohepta(b)pyridin-9-yl ester, sulfate, hydrate (2:1:3)
Molecular Formula
C56H64F4N12O13S
Molecular Weight
1221.2  g/mol
InChI Key
SOGUOEZRYKUOHR-CQZKMDJHSA-N
FDA UNII
1383NM3Q0H

Rimegepant Sulfate
1 2D Structure

Rimegepant Sulfate

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
[(5S,6S,9R)-5-amino-6-(2,3-difluorophenyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-9-yl] 4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxylate;sulfuric acid;trihydrate
2.1.2 InChI
InChI=1S/2C28H28F2N6O3.H2O4S.3H2O/c2*29-20-6-1-4-17(23(20)30)18-8-9-22(25-19(24(18)31)5-2-12-32-25)39-28(38)35-14-10-16(11-15-35)36-21-7-3-13-33-26(21)34-27(36)37;1-5(2,3)4;;;/h2*1-7,12-13,16,18,22,24H,8-11,14-15,31H2,(H,33,34,37);(H2,1,2,3,4);3*1H2/t2*18-,22+,24-;;;;/m00..../s1
2.1.3 InChI Key
SOGUOEZRYKUOHR-CQZKMDJHSA-N
2.1.4 Canonical SMILES
C1CC(C2=C(C=CC=N2)C(C1C3=C(C(=CC=C3)F)F)N)OC(=O)N4CCC(CC4)N5C6=C(NC5=O)N=CC=C6.C1CC(C2=C(C=CC=N2)C(C1C3=C(C(=CC=C3)F)F)N)OC(=O)N4CCC(CC4)N5C6=C(NC5=O)N=CC=C6.O.O.O.OS(=O)(=O)O
2.1.5 Isomeric SMILES
C1C[C@H](C2=C(C=CC=N2)[C@H]([C@@H]1C3=C(C(=CC=C3)F)F)N)OC(=O)N4CCC(CC4)N5C6=C(NC5=O)N=CC=C6.C1C[C@H](C2=C(C=CC=N2)[C@H]([C@@H]1C3=C(C(=CC=C3)F)F)N)OC(=O)N4CCC(CC4)N5C6=C(NC5=O)N=CC=C6.O.O.O.OS(=O)(=O)O
2.2 Other Identifiers
2.2.1 UNII
1383NM3Q0H
2.3 Synonyms
2.3.1 MeSH Synonyms

1. (5s,6s,9r)-5-amino-6-(2,3-difluorophenyl)-6,7,8,9-tetrahydro-5h-cyclohepta(b)pyridin-9-yl 4-(2-oxo-2,3-dihydro-1h-imidazo(4,5-b)pyridin-1-yl)piperidine-1-carboxylate

2. Bms-927711

3. Nurtec Odt

4. Rimegepant

2.3.2 Depositor-Supplied Synonyms

1. Nurtec Odt

2. Rimegepant Sulfate [usan]

3. 1374024-48-2

4. 1383nm3q0h

5. Rimegepant Sulfate (usan)

6. 1-piperidinecarboxylic Acid, 4-(2,3-dihydro-2-oxo-1h-imidazo(4,5-b)pyridin-1-yl)-, (5s,6s,9r)-5-amino-6-(2,3-difluorophenyl)-6,7,8,9-tetrahydro-5h-cyclohepta(b)pyridin-9-yl Ester, Sulfate, Hydrate (2:1:3)

7. Di((5s,6s,9r)-5-amino-6-(2,3-difluorophenyl)-6,7,8,9-tetrahydro-5h-cyclohepta(b)pyridin-9-yl 4-(2-oxo-2,3-dihydro-1h-imidazo(4,5-b)pyridin-1-yl)piperidine-1-carboxylate), Monosulfate, Trihydrate

8. Unii-1383nm3q0h

9. Nurtec Odt (tn)

10. Rimegepant Sulfate Dihydrate

11. Chembl2364629

12. Dtxsid60160174

13. Rimegepant Sulfate [who-dd]

14. Rimegepant Sulfate [orange Book]

15. Rimegepant Hemisulfate Sesquihydrate

16. D10663

17. Rimegepant Hemisulfate Sesquihydrate [mi]

18. Q27251488

2.4 Create Date
2013-07-08
3 Chemical and Physical Properties
Molecular Weight 1221.2 g/mol
Molecular Formula C56H64F4N12O13S
Hydrogen Bond Donor Count9
Hydrogen Bond Acceptor Count23
Rotatable Bond Count8
Exact Mass1220.43726396 g/mol
Monoisotopic Mass1220.43726396 g/mol
Topological Polar Surface Area313 Ų
Heavy Atom Count86
Formal Charge0
Complexity973
Isotope Atom Count0
Defined Atom Stereocenter Count6
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count6
4 Pharmacology and Biochemistry
4.1 FDA Pharmacological Classification
4.1.1 Pharmacological Classes
Calcitonin Gene-related Peptide Receptor Antagonists [MoA]; Calcitonin Gene-related Peptide Receptor Antagonist [EPC]

API SUPPLIERS

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01

Moehs Iberica

Spain

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Virtual BoothMoehs Group, a reference company in the production of pharmaceutical active ingredients.

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02

Metrochem API Private Limited

India

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Virtual BoothMetrochem has been delivering customized volume & quality products to customers across the world, taking utmost care of their needs.

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03

Jinan Tantu Chemicals

China

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Virtual BoothJinan Tantu Chemicals offers customized R&D services & production of small molecule APIs & pharmaceutical intermediates.

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Medichem S.A

Spain

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Virtual BoothMedichem is a vertically integrated pharmaceutical company specializing in the development & manufacturing of APIs & FDFs.

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05

Shandong Boyuan Pharmaceutical

China

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Porton Pharma Solutions

China

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Virtual BoothPorton Pharma Solutions: Value creation via innovation & discovery through technical platforms.

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07

Changzhou Pharmaceutical Factory

China

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China

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MSN Laboratories

India

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Teva Pharmaceutical Industries

Israel

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Aurobindo Pharma Limited

India

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Aurobindo Pharma Limited

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API Reference Price

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HEATHROW","customer":"PROJECT MANAGER.","customerCountry":"UNITED KINGDOM","quantity":"89.70","actualQuantity":"89.7","unit":"KGS","unitRateFc":"13534.4","totalValueFC":"1206117.2","currency":"USD","unitRateINR":1119297.6588628762,"date":"30-Dec-2023","totalValueINR":"100401000","totalValueInUsd":"1206117.2","indian_port":"Bangalore Air","hs_no":"29333100","bill_no":"6431181","productDescription":"API","marketType":"REGULATED MARKET","country":"UNITED KINGDOM","selfForZScoreResived":"Pharma Grade","supplierPort":"Bangalore Air","supplierAddress":"PLOT.NO.49,CANARA BANK ROAD,BOMMASANDRA INDL.AREA,, PHASE-I,BANGALORE","customerAddress":""},{"dataSource":"API Export","activeIngredients":"","year":"2024","qtr":"Q1","strtotime":1709317800,"product":"RIMEGEPANT SULFATE (RES)","address":"PLOT NO.C-24, MSN HOUSE, INDUSTRIAL","city":"HYDERABAD, AP","supplier":"MSN LABORATORIES","supplierCountry":"INDIA","foreign_port":"ISTANBUL","customer":"MERKO PHARMACEUTICAL & ","customerCountry":"TURKEY","quantity":"2.00","actualQuantity":"2","unit":"KGS","unitRateFc":"30000","totalValueFC":"63145.6","currency":"EUR","unitRateINR":2621672.1699999999,"date":"02-Mar-2024","totalValueINR":"5243344.34","totalValueInUsd":"63145.6","indian_port":"Hyderabad Air","hs_no":"29349990","bill_no":"8001178","productDescription":"API","marketType":"LESS REGULATED MARKET","country":"TURKEY","selfForZScoreResived":"Pharma Grade","supplierPort":"Hyderabad Air","supplierAddress":"PLOT NO.C-24, MSN HOUSE, INDUSTRIAL, HYDERABAD, AP","customerAddress":""},{"dataSource":"API Export","activeIngredients":"","year":"2024","qtr":"Q1","strtotime":1709663400,"product":"RIMEGEPANT SULFATE","address":"FLAT NO.302, BHANU ENCLAVE","city":"HYDERABAD.AP","supplier":"METROCHEM API PRIVATE LIMITED","supplierCountry":"INDIA","foreign_port":"RIO DE JANEIRO - GAL","customer":"M\/S.ABBOTT LABORATORIES DO BRASIL","customerCountry":"BRAZIL","quantity":"3.00","actualQuantity":"3","unit":"KGS","unitRateFc":"10500","totalValueFC":"31050.5","currency":"USD","unitRateINR":859433.33333333337,"date":"06-Mar-2024","totalValueINR":"2578300","totalValueInUsd":"31050.5","indian_port":"Hyderabad Air","hs_no":"29333990","bill_no":"8108775","productDescription":"API","marketType":"LESS REGULATED MARKET","country":"BRAZIL","selfForZScoreResived":"Pharma Grade","supplierPort":"Hyderabad Air","supplierAddress":"FLAT NO.302, BHANU ENCLAVE, HYDERABAD.AP","customerAddress":""},{"dataSource":"API Export","activeIngredients":"","year":"2024","qtr":"Q1","strtotime":1711737000,"product":"FINE ORGANIC COMPOUND.-WE INTEND TO CLAIM UNDER RODTEP SCHEME .RIMEGEPANT SULFATE.BATCH# A012440060,A012440067,**","address":"PLOT.NO.49,CANARA BANK ROAD,BOMMASANDRA INDL.AREA,","city":"PHASE-I,BANGALORE","supplier":"ANTHEM BIOSCIENCES","supplierCountry":"INDIA","foreign_port":"LONDON METROPOLITAN","customer":"PROJECT MANAGER","customerCountry":"UNITED KINGDOM","quantity":"299.30","actualQuantity":"299.3","unit":"KGS","unitRateFc":"13534.4","totalValueFC":"4012520.6","currency":"USD","unitRateINR":1113206.8676912796,"date":"30-Mar-2024","totalValueINR":"333182815.5","totalValueInUsd":"4012520.6","indian_port":"Bangalore Air","hs_no":"29333100","bill_no":"8784526","productDescription":"API","marketType":"REGULATED MARKET","country":"UNITED KINGDOM","selfForZScoreResived":"Pharma Grade","supplierPort":"Bangalore Air","supplierAddress":"PLOT.NO.49,CANARA BANK ROAD,BOMMASANDRA INDL.AREA,, PHASE-I,BANGALORE","customerAddress":""},{"dataSource":"API Export","activeIngredients":"","year":"2024","qtr":"Q2","strtotime":1714329000,"product":"FINE ORGANIC COMPOUND,WE INTEND TO CLAIMUNDER RODTEP SCHEME, BATCH A062440069 A062440073 A062440077 RIMEGEPANT SULFATE","address":"PLOT.NO.49,CANARA BANK ROAD,BOMMASANDRA INDL.AREA,","city":"PHASE-I,BANGALORE","supplier":"ANTHEM BIOSCIENCES","supplierCountry":"INDIA","foreign_port":"LONDON - HEATHROW","customer":"PROJECT MANAGER","customerCountry":"UNITED KINGDOM","quantity":"248.00","actualQuantity":"248","unit":"KGS","unitRateFc":"10837.9","totalValueFC":"2661819.8","currency":"USD","unitRateINR":896295.98387096776,"date":"29-Apr-2024","totalValueINR":"222281404","totalValueInUsd":"2661819.8","indian_port":"Bangalore Air","hs_no":"29333100","bill_no":"9502091","productDescription":"API","marketType":"REGULATED MARKET","country":"UNITED KINGDOM","selfForZScoreResived":"Pharma Grade","supplierPort":"Bangalore Air","supplierAddress":"PLOT.NO.49,CANARA BANK ROAD,BOMMASANDRA INDL.AREA,, PHASE-I,BANGALORE","customerAddress":""},{"dataSource":"API Export","activeIngredients":"","year":"2024","qtr":"Q3","strtotime":1723401000,"product":"(5S,6S,9R)-5-AMINO-6-(2,3-DIFLUOROPHENYL-6,7,8,9-TETRAHYDRO-5H-CYCLOHEPTA(B)PYRIDIN-...(RIMEGEPANT SULFATE)","address":"101, SAPTAGIRI RESIDENCY,1-10-98\/A, CHIKOTI GARDENS, BEGUMPET,","city":"HYDERABAD, AP.","supplier":"ESCIENTIA ADVANCED SCIENCES PRIVATE LIMITED","supplierCountry":"INDIA","foreign_port":"LONDON","customer":"CATALENT MICRON TECHNOLOGIES, LTD","customerCountry":"UNITED KINGDOM","quantity":"130.65","actualQuantity":"130.65","unit":"KGS","unitRateFc":"12152","totalValueFC":"1568190.5","currency":"USD","unitRateINR":1006793.2,"date":"12-Aug-2024","totalValueINR":"131537531.58","totalValueInUsd":"1568190.5","indian_port":"Vizag-APIICL SEZ","hs_no":"29333100","bill_no":"3137656","productDescription":"API","marketType":"REGULATED MARKET","country":"UNITED KINGDOM","selfForZScoreResived":"Pharma Grade","supplierPort":"Vizag-APIICL SEZ","supplierAddress":"101, SAPTAGIRI RESIDENCY,1-10-98\/A, CHIKOTI GARDENS, BEGUMPET,, HYDERABAD, AP.","customerAddress":""},{"dataSource":"API Export","activeIngredients":"","year":"2024","qtr":"Q3","strtotime":1725042600,"product":"FINE ORGANIC COMPOUND-WE INTEND TO CLAIMTHE BENEFIT UNDER RODTEP SCHEME (BATCHNO:A012440171) RIMEGEPANT SULFATE","address":"PLOT.NO.49,CANARA BANK ROAD,BOMMASANDRA INDL.AREA,","city":"PHASE-I,BANGALORE","supplier":"ANTHEM BIOSCIENCES","supplierCountry":"INDIA","foreign_port":"LONDON - HEATHROW","customer":"PROJECT MANAGER","customerCountry":"UNITED KINGDOM","quantity":"28.70","actualQuantity":"28.7","unit":"KGS","unitRateFc":"12210","totalValueFC":"347174.4","currency":"USD","unitRateINR":1014651,"date":"31-Aug-2024","totalValueINR":"29120483.7","totalValueInUsd":"347174.4","indian_port":"Bangalore Air","hs_no":"29333100","bill_no":"3662092","productDescription":"API","marketType":"REGULATED MARKET","country":"UNITED KINGDOM","selfForZScoreResived":"Pharma Grade","supplierPort":"Bangalore Air","supplierAddress":"PLOT.NO.49,CANARA BANK ROAD,BOMMASANDRA INDL.AREA,, PHASE-I,BANGALORE","customerAddress":""}]
07-Aug-2021
31-Aug-2024
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FDF Dossiers

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01

Pfizer Inc

U.S.A
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Pfizer Inc

U.S.A
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Luxepack
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RIMEGEPANT SULFATE

Brand Name : NURTEC ODT

Dosage Form : TABLET, ORALLY DISINTEGRATING;ORAL

Dosage Strength : EQ 75MG BASE

Packaging :

Approval Date : 2020-02-27

Application Number : 212728

Regulatory Info : RX

Registration Country : USA

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02

Pfizer Inc

U.S.A
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Pfizer Inc

U.S.A
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Rimegepantum

Brand Name : Vydura ODT

Dosage Form : Schmelztabl

Dosage Strength : 75mg

Packaging :

Approval Date :

Application Number :

Regulatory Info :

Registration Country : Switzerland

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03

Pfizer Inc

U.S.A
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Pfizer Inc

U.S.A
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Rimegepantum

Brand Name : Vydura ODT

Dosage Form : Schmelztabl

Dosage Strength : 75mg

Packaging :

Approval Date :

Application Number :

Regulatory Info :

Registration Country : Switzerland

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04

Pfizer Inc

U.S.A
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Pfizer Inc

U.S.A
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Rimegepantum

Brand Name : Vydura ODT

Dosage Form : Schmelztabl

Dosage Strength : 75mg

Packaging :

Approval Date :

Application Number :

Regulatory Info :

Registration Country : Switzerland

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