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Chemistry

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Also known as: 860642-69-9, Vpd-737, Serlopitant [usan], Mk-0594, Chembl447955, 3-((3ar,4r,5s,7as)-5-((r)-1-(3,5-bis(trifluoromethyl)phenyl)ethoxy)-4-(4-fluorophenyl)hexahydro-1h-isoindol-2(3h)-yl)cyclopent-2-enone
Molecular Formula
C29H28F7NO2
Molecular Weight
555.5  g/mol
InChI Key
FLNYCRJBCNNHRH-OIYLJQICSA-N
FDA UNII
277V92K32B

Serlopitant
Serlopitant has been investigated for the treatment of Prurigo Nodularis.
1 2D Structure

Serlopitant

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
3-[(3aR,4R,5S,7aS)-5-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-4-(4-fluorophenyl)-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl]cyclopent-2-en-1-one
2.1.2 InChI
InChI=1S/C29H28F7NO2/c1-16(19-10-20(28(31,32)33)12-21(11-19)29(34,35)36)39-26-9-4-18-14-37(23-7-8-24(38)13-23)15-25(18)27(26)17-2-5-22(30)6-3-17/h2-3,5-6,10-13,16,18,25-27H,4,7-9,14-15H2,1H3/t16-,18-,25-,26+,27+/m1/s1
2.1.3 InChI Key
FLNYCRJBCNNHRH-OIYLJQICSA-N
2.1.4 Canonical SMILES
CC(C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)OC2CCC3CN(CC3C2C4=CC=C(C=C4)F)C5=CC(=O)CC5
2.1.5 Isomeric SMILES
C[C@H](C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)O[C@H]2CC[C@@H]3CN(C[C@H]3[C@@H]2C4=CC=C(C=C4)F)C5=CC(=O)CC5
2.2 Other Identifiers
2.2.1 UNII
277V92K32B
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 860642-69-9

2. Vpd-737

3. Serlopitant [usan]

4. Mk-0594

5. Chembl447955

6. 3-((3ar,4r,5s,7as)-5-((r)-1-(3,5-bis(trifluoromethyl)phenyl)ethoxy)-4-(4-fluorophenyl)hexahydro-1h-isoindol-2(3h)-yl)cyclopent-2-enone

7. Serlopitant (usan)

8. 277v92k32b

9. 3-((3ar,4r,5s,7as)-5-((1r)-1-(3,5-bis(trifluoromethyl)phenyl)ethoxy)-4-(4 Fluorophenyl)octahydro-2h-isoindol-2-yl)cyclopent-2-en-1-one

10. 3-[(3ar,4r,5s,7as)-5-[(1r)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-4-(4-fluorophenyl)-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl]cyclopent-2-en-1-one

11. Serlopitant [usan:inn]

12. Unii-277v92k32b

13. Vpd 737

14. Serlopitant [inn]

15. Serlopitant [who-dd]

16. Gtpl9280

17. Schembl3183159

18. C29h28f7no2

19. Dtxsid701006599

20. Bdbm50277511

21. Mfcd18782619

22. Compound 17 (jiang Et Al. 2009)

23. Db12973

24. Vpd-737; Mk-0594

25. Hy-12114

26. Cs-0003087

27. D09378

28. Q21098912

29. 2-cyclopenten-1-one, 3-((3ar,4r,5s,7as)-5-((1r)-1-(3,5-bis(trifluoromethyl)phenyl)ethoxy)-4-(4-fluorophenyl)octahydro-2h-isoindol-2-yl)-

30. 3-((3ar,4r,5s,7as)-5-((r)-1-(3,5-bis(trifluoromethyl)phenyl)ethoxy)-4-(4-fluorophenyl)octahydro-2h-isoindol-2-yl)cyclopent-2-en-1-one

31. 3-[(3ar,4r,5s,7as)-5-{(1r)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy}-4-(4-fluorophenyl)-octahydro-2h-isoindol-2-yl]cyclopent-2-en-1-one

32. 3-[(3ar,4r,5s,7as)-5-{(1r)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy}-4-(4-fluorophenyl)octahydro-1h-isoindol-2-yl]cyclopent-2-en-1-one

33. 3-[5-{1-[3,5-bis(trifluoromethyl)phenyl]ethoxy}-4-(4-fluorophenyl)octahydro-2h-isoindol-2-yl]cyclopent-2-en-1-one

2.4 Create Date
2008-01-28
3 Chemical and Physical Properties
Molecular Weight 555.5 g/mol
Molecular Formula C29H28F7NO2
XLogP36.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count10
Rotatable Bond Count5
Exact Mass555.20082627 g/mol
Monoisotopic Mass555.20082627 g/mol
Topological Polar Surface Area29.5 Ų
Heavy Atom Count39
Formal Charge0
Complexity888
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Drug and Medication Information
4.1 Drug Indication

Treatment of prurigo nodularis


5 Pharmacology and Biochemistry
5.1 MeSH Pharmacological Classification

Neurokinin-1 Receptor Antagonists

Compounds that inhibit or block the activity of NEUROKININ-1 RECEPTORS. (See all compounds classified as Neurokinin-1 Receptor Antagonists.)


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ABOUT THIS PAGE

Serlopitant Manufacturers

A Serlopitant manufacturer is defined as any person or entity involved in the manufacture, preparation, processing, compounding or propagation of Serlopitant, including repackagers and relabelers. The FDA regulates Serlopitant manufacturers to ensure that their products comply with relevant laws and regulations and are safe and effective to use. Serlopitant API Manufacturers are required to adhere to Good Manufacturing Practices (GMP) to ensure that their products are consistently manufactured to meet established quality criteria.

Serlopitant Suppliers

A Serlopitant supplier is an individual or a company that provides Serlopitant active pharmaceutical ingredient (API) or Serlopitant finished formulations upon request. The Serlopitant suppliers may include Serlopitant API manufacturers, exporters, distributors and traders.

Serlopitant GMP

Serlopitant Active pharmaceutical ingredient (API) is produced in GMP-certified manufacturing facility.

GMP stands for Good Manufacturing Practices, which is a system used in the pharmaceutical industry to make sure that goods are regularly produced and monitored in accordance with quality standards. The FDA’s current Good Manufacturing Practices requirements are referred to as cGMP or current GMP which indicates that the company follows the most recent GMP specifications. The World Health Organization (WHO) has its own set of GMP guidelines, called the WHO GMP. Different countries can also set their own guidelines for GMP like China (Chinese GMP) or the EU (EU GMP).

PharmaCompass offers a list of Serlopitant GMP manufacturers, exporters & distributors, which can be sorted by USDMF, JDMF, KDMF, CEP (COS), WC, API price, and more, enabling you to easily find the right Serlopitant GMP manufacturer or Serlopitant GMP API supplier for your needs.

Serlopitant CoA

A Serlopitant CoA (Certificate of Analysis) is a formal document that attests to Serlopitant's compliance with Serlopitant specifications and serves as a tool for batch-level quality control.

Serlopitant CoA mostly includes findings from lab analyses of a specific batch. For each Serlopitant CoA document that a company creates, the USFDA specifies specific requirements, such as supplier information, material identification, transportation data, evidence of conformity and signature data.

Serlopitant may be tested according to a variety of international standards, such as European Pharmacopoeia (Serlopitant EP), Serlopitant JP (Japanese Pharmacopeia) and the US Pharmacopoeia (Serlopitant USP).

Inform the supplier about your product requirements, specifying if you need a product with particular monograph like EP (Ph. Eur.), USP, JP, BP, or any other quality. In addition, clarify whether you need hydrochloride (HCl), anhydricum, base, micronisatum or a specific level of purity. To find reputable suppliers, utilize the filters and select those certified by GMP, FDA, or any other certification as per your requirement.
For your convenience, we have listed synonyms and CAS numbers to help you find the best supplier. The use of synonyms and CAS numbers can be helpful in identifying potential suppliers, but it is crucial to note that they might not always indicate the exact same product. It is important to confirm the product details with the supplier before making a purchase to ensure that it meets your requirements.
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