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Chemistry

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Also known as: 334476-46-9, Vestipitant [inn], Gw597599, Gw-597599, S052toi9bi, (2s)-n-[(1r)-1-[3,5-bis(trifluoromethyl)phenyl]ethyl]-2-(4-fluoro-2-methylphenyl)-n-methylpiperazine-1-carboxamide
Molecular Formula
C23H24F7N3O
Molecular Weight
491.4  g/mol
InChI Key
SBBYBXSFWOLDDG-JLTOFOAXSA-N
FDA UNII
S052TOI9BI

Vestipitant
Vestipitant has been investigated for the treatment of Tinnitus.
1 2D Structure

Vestipitant

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(2S)-N-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethyl]-2-(4-fluoro-2-methylphenyl)-N-methylpiperazine-1-carboxamide
2.1.2 InChI
InChI=1S/C23H24F7N3O/c1-13-8-18(24)4-5-19(13)20-12-31-6-7-33(20)21(34)32(3)14(2)15-9-16(22(25,26)27)11-17(10-15)23(28,29)30/h4-5,8-11,14,20,31H,6-7,12H2,1-3H3/t14-,20-/m1/s1
2.1.3 InChI Key
SBBYBXSFWOLDDG-JLTOFOAXSA-N
2.1.4 Canonical SMILES
CC1=C(C=CC(=C1)F)C2CNCCN2C(=O)N(C)C(C)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F
2.1.5 Isomeric SMILES
CC1=C(C=CC(=C1)F)[C@H]2CNCCN2C(=O)N(C)[C@H](C)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F
2.2 Other Identifiers
2.2.1 UNII
S052TOI9BI
2.3 Synonyms
2.3.1 MeSH Synonyms

1. Gw-597599

2. Gw597599

2.3.2 Depositor-Supplied Synonyms

1. 334476-46-9

2. Vestipitant [inn]

3. Gw597599

4. Gw-597599

5. S052toi9bi

6. (2s)-n-[(1r)-1-[3,5-bis(trifluoromethyl)phenyl]ethyl]-2-(4-fluoro-2-methylphenyl)-n-methylpiperazine-1-carboxamide

7. Unii-s052toi9bi

8. Vestipitant [who-dd]

9. Chembl522987

10. Gtpl5757

11. Schembl2485871

12. Dtxsid50187092

13. Bdbm50413891

14. Db11949

15. Q12747348

16. (2s)-n-[(r)-1-[3,5-bis(trifluoromethyl)phenyl]ethyl]-n-methyl-2-(4-fluoro-2-methylphenyl)-1-piperazinecarboxamide

17. 1-piperazinecarboxamide, N-((1r)-1-(3,5-bis(trifluoromethyl)phenyl)ethyl)-2-(4-fluoro-2-methylphenyl)-n-methyl-, (2s)-

18. 1-piperazinecarboxamide, N-(1-(3,5-bis(trifluoromethyl)phenyl)ethyl)-2-(4-fluoro-2-methylphenyl)-n-methyl-

19. 2(s)-(4-fluoro-2-methyl-phenyl)-piperazine-1-carboxylic Acid [1-(r)-(3,5-bis-trifluoromethyl-phenyl)-ethyl]-methyl-amide

20. 2-(s)-(4-fluoro-2-methyl-phenyl)-piperazine-1 Carboxylic Acid [1-(r)-(3,5-bis-trifluoromethyl-phenyl)-ethyl]-methyl-amide

21. 2-(s)-(4-fluoro-2-methyl-phenyl)-piperazine-1-carboxylic Acid [1-(r)-(3,5-bis-trifluoromethyl-phenyl)-ethyl]-methyl-amide

2.4 Create Date
2006-10-25
3 Chemical and Physical Properties
Molecular Weight 491.4 g/mol
Molecular Formula C23H24F7N3O
XLogP34.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count3
Exact Mass491.18075953 g/mol
Monoisotopic Mass491.18075953 g/mol
Topological Polar Surface Area35.6 Ų
Heavy Atom Count34
Formal Charge0
Complexity679
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Pharmacology and Biochemistry
4.1 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.)


ABOUT THIS PAGE

Looking for 334476-46-9 / Vestipitant API manufacturers, exporters & distributors?

Vestipitant manufacturers, exporters & distributors 1

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

Send us enquiries for free, and we will assist you in establishing a direct connection with your preferred Vestipitant manufacturer or Vestipitant supplier.

PharmaCompass also assists you with knowing the Vestipitant API Price utilized in the formulation of products. Vestipitant API Price is not always fixed or binding as the Vestipitant Price is obtained through a variety of data sources. The Vestipitant Price can also vary due to multiple factors, including market conditions, regulatory modifications, or negotiated pricing deals.

API | Excipient name

Vestipitant

Synonyms

334476-46-9, Vestipitant [inn], Gw597599, Gw-597599, S052toi9bi, (2s)-n-[(1r)-1-[3,5-bis(trifluoromethyl)phenyl]ethyl]-2-(4-fluoro-2-methylphenyl)-n-methylpiperazine-1-carboxamide

Cas Number

334476-46-9

Unique Ingredient Identifier (UNII)

S052TOI9BI

About Vestipitant

Vestipitant has been investigated for the treatment of Tinnitus.

Vestipitant Manufacturers

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

Vestipitant Suppliers

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

Vestipitant GMP

Vestipitant 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 Vestipitant 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 Vestipitant GMP manufacturer or Vestipitant GMP API supplier for your needs.

Vestipitant CoA

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

Vestipitant CoA mostly includes findings from lab analyses of a specific batch. For each Vestipitant 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.

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