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Chemistry

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Also known as:
Molecular Formula
C31H33N5O4
Molecular Weight
539.6  g/mol
InChI Key
XZXHXSATPCNXJR-ZIADKAODSA-N

Nintedanib Esylate
1 2D Structure

Nintedanib Esylate

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
methyl (3Z)-3-[[4-[methyl-[2-(4-methylpiperazin-1-yl)acetyl]amino]anilino]-phenylmethylidene]-2-oxo-1H-indole-6-carboxylate
2.1.2 InChI
InChI=1S/C31H33N5O4/c1-34-15-17-36(18-16-34)20-27(37)35(2)24-12-10-23(11-13-24)32-29(21-7-5-4-6-8-21)28-25-14-9-22(31(39)40-3)19-26(25)33-30(28)38/h4-14,19,32H,15-18,20H2,1-3H3,(H,33,38)/b29-28-
2.1.3 InChI Key
XZXHXSATPCNXJR-ZIADKAODSA-N
2.1.4 Canonical SMILES
CN1CCN(CC1)CC(=O)N(C)C2=CC=C(C=C2)NC(=C3C4=C(C=C(C=C4)C(=O)OC)NC3=O)C5=CC=CC=C5
2.1.5 Isomeric SMILES
CN1CCN(CC1)CC(=O)N(C)C2=CC=C(C=C2)N/C(=C\3/C4=C(C=C(C=C4)C(=O)OC)NC3=O)/C5=CC=CC=C5
2.2 Create Date
2006-10-25
3 Chemical and Physical Properties
Molecular Weight 539.6 g/mol
Molecular Formula C31H33N5O4
XLogP33.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count8
Exact Mass539.25325455 g/mol
Monoisotopic Mass539.25325455 g/mol
Topological Polar Surface Area94.2 A^2
Heavy Atom Count40
Formal Charge0
Complexity947
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Drug and Medication Information
4.1 Drug Information
1 of 2  
Drug NameOfev
Drug LabelOFEV capsules contain nintedanib, a kinase inhibitor [see Mechanism of Action (12.1)]. Nintedanib is presented as the ethanesulfonate salt (esylate), with the chemical name 1H-Indole-6-carboxylic acid, 2,3-dihydro-3-[[[4-[methyl[(4-methyl-1-piperazin...
Active IngredientNintedanib
Dosage FormCapsule
RouteOral
Strength150mg; 100mg
Market StatusPrescription
CompanyBoehringer Ingelheim

2 of 2  
Drug NameOfev
Drug LabelOFEV capsules contain nintedanib, a kinase inhibitor [see Mechanism of Action (12.1)]. Nintedanib is presented as the ethanesulfonate salt (esylate), with the chemical name 1H-Indole-6-carboxylic acid, 2,3-dihydro-3-[[[4-[methyl[(4-methyl-1-piperazin...
Active IngredientNintedanib
Dosage FormCapsule
RouteOral
Strength150mg; 100mg
Market StatusPrescription
CompanyBoehringer Ingelheim

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AP","customerAddress":""},{"dataSource":"API Import","activeIngredients":"","year":"2022","qtr":"Q3","strtotime":1661970600,"product":"NINTEDANIB ESYALTE - HY-11106 (1H-INDOLE-6-CARBOXYLIC ACID, 2,3-DIHYDRO-3-[[[4-[METHYL[2-(4-METHYL-1-PIPERAZINYL)ACETYL]","address":"28\/A, IDA, NACHARAM, Contact No: 919989112452","city":"HYDERABAD","supplier":"MEDCHEMEXPRESS LLC","supplierCountry":"UNITED STATES","foreign_port":"NA","customer":"ARAGEN LIFE SCIENCES","customerCountry":"INDIA","quantity":"0.05","actualQuantity":"45","unit":"GMS","unitRateFc":"128.7","totalValueFC":"5819","currency":"USD","unitRateINR":"10363.1","date":"01-Sep-2022","totalValueINR":"466340.53","totalValueInUsd":"5819","indian_port":"BANGALORE AIR","hs_no":"29339990","bill_no":"2255154","productDescription":"API","marketType":"REGULATED MARKET","country":"UNITED STATES","selfForZScoreResived":"Pharma Grade","supplierPort":"NA","supplierAddress":"","customerAddress":"28\/A, IDA, NACHARAM, Contact No: 919989112452"},{"dataSource":"API Import","activeIngredients":"","year":"2024","qtr":"Q4","strtotime":1728498600,"product":"NINTEDANIB ESYLATE (VIDE RE IMPORT SB NO: 2643464 DT:23.07.2024)","address":"MSN HOUSE, PLOT NO. C-24,","city":"HYDERABAD. AP","supplier":"VERBEN AG","supplierCountry":"INDIA","foreign_port":"DUBAI","customer":"MSN LABORATORIES","customerCountry":"INDIA","quantity":"7.00","actualQuantity":"7","unit":"KGS","unitRateFc":"3465","totalValueFC":"24768.2","currency":"USD","unitRateINR":"297312.8","date":"10-Oct-2024","totalValueINR":"2081189.66","totalValueInUsd":"24768.2","indian_port":"Hyderabad Air","hs_no":"29337990","bill_no":"6055000","productDescription":"Re-Import","marketType":"REGULATED MARKET","country":"INDIA","selfForZScoreResived":"Pharma Grade","supplierPort":"DUBAI","supplierAddress":"LUGANO BRANCH, VIA F. PELLI 17, PO BOX 6901 LUGANO , LUGANO -6901,SWIT ZERLAND Switzerland","customerAddress":"MSN HOUSE, PLOT NO. C-24,"}]
20-Jan-2021
10-Oct-2024
KGS
overview
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Average Price (USD/KGS)

Number of Transactions

Total Quantity (KGS)

Total Value (USD)

Quantity (KGS) & Unit rate (USD/KGS) over time

API Imports and Exports

Importing Country Total Quantity
(KGS)
Average Price
(USD/KGS)
Number of Transactions

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