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Chemistry

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Also known as: Cpi-0610, 1380087-89-7, Cpi 0610, (s)-2-(6-(4-chlorophenyl)-1-methyl-4h-benzo[c]isoxazolo[4,5-e]azepin-4-yl)acetamide, Chembl4303404, Cpi-232
Molecular Formula
C20H16ClN3O2
Molecular Weight
365.8  g/mol
InChI Key
GCWIQUVXWZWCLE-INIZCTEOSA-N
FDA UNII
U4017GUQ06

Pelabresib
Pelabresib Anhydrous is the anhydrous form of pelabresib, a small molecule inhibitor of the Bromodomain and Extra-Terminal (BET) family of proteins, with potential antineoplastic activity. Upon administration, pelabresib binds to the acetylated lysine recognition motifs on the bromodomain of BET proteins, thereby preventing the interaction between the BET proteins and acetylated histone peptides. This disrupts chromatin remodeling and gene expression. Prevention of the expression of certain growth-promoting genes may lead to an inhibition of tumor cell growth. Characterized by a tandem repeat of two bromodomains at the N-terminus, the BET proteins (BRD2, BRD3, BRD4 and BRDT) are transcriptional regulators that play an important role during development and cellular growth.
1 2D Structure

Pelabresib

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-[(4S)-6-(4-chlorophenyl)-1-methyl-4H-[1,2]oxazolo[5,4-d][2]benzazepin-4-yl]acetamide
2.1.2 InChI
InChI=1S/C20H16ClN3O2/c1-11-18-14-4-2-3-5-15(14)19(12-6-8-13(21)9-7-12)23-16(10-17(22)25)20(18)26-24-11/h2-9,16H,10H2,1H3,(H2,22,25)/t16-/m0/s1
2.1.3 InChI Key
GCWIQUVXWZWCLE-INIZCTEOSA-N
2.1.4 Canonical SMILES
CC1=NOC2=C1C3=CC=CC=C3C(=NC2CC(=O)N)C4=CC=C(C=C4)Cl
2.1.5 Isomeric SMILES
CC1=NOC2=C1C3=CC=CC=C3C(=N[C@H]2CC(=O)N)C4=CC=C(C=C4)Cl
2.2 Other Identifiers
2.2.1 UNII
U4017GUQ06
2.3 Synonyms
2.3.1 MeSH Synonyms

1. Cpi-0610

2.3.2 Depositor-Supplied Synonyms

1. Cpi-0610

2. 1380087-89-7

3. Cpi 0610

4. (s)-2-(6-(4-chlorophenyl)-1-methyl-4h-benzo[c]isoxazolo[4,5-e]azepin-4-yl)acetamide

5. Chembl4303404

6. Cpi-232

7. U4017guq06

8. Pelabresib

9. Cpi-267232

10. 2-[(4s)-6-(4-chlorophenyl)-1-methyl-4h-[1,2]oxazolo[5,4-d][2]benzazepin-4-yl]acetamide

11. Cpi0610

12. 2-((4s)-6-(4-chlorophenyl)-1-methyl-4h-isoxazolo(5,4-d)(2)benzazepin-4-yl)acetamide

13. 4h-isoxazolo(5,4-d)(2)benzazepine-4-acetamide, 6-(4-chlorophenyl)-1-methyl-, (4s)

14. Pelabresib [inn]

15. Pelabresib Anhydrous

16. Unii-u4017guq06

17. Gtpl9120

18. Schembl15926539

19. Dtxsid201022544

20. Bcp10741

21. Ex-a1612

22. Bdbm50510872

23. Nsc784856

24. S7853

25. Akos030526467

26. Zinc200480149

27. Cs-5592

28. Nsc-784856

29. Compound 10 [pmid: 26815195]

30. Ncgc00483135-01

31. As-73876

32. Bc177446

33. Hy-12863

34. J3.554.939k

35. Q27076907

36. 2-((4s)-6-(4-chlorophenyl)-1-methyl-4h-benzo[c]isoxazolo[4,5-e]azepin-4-yl)acetamide

37. 2-((4s)-6-(4-chlorophenyl)-1-methyl-4h-benzo[e]isoxazolo[5,4-c]azepin-4-yl)acetamide

38. 2-[(7s)-9-(4-chlorophenyl)-3-methyl-5-oxa-4,8-diazatricyclo[8.4.0.0(2),?]tetradeca-1(10),2(6),3,8,11,13-hexaen-7-yl]acetamide

39. 62g

2.4 Create Date
2012-07-23
3 Chemical and Physical Properties
Molecular Weight 365.8 g/mol
Molecular Formula C20H16ClN3O2
XLogP33
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass365.0931045 g/mol
Monoisotopic Mass365.0931045 g/mol
Topological Polar Surface Area81.5 Ų
Heavy Atom Count26
Formal Charge0
Complexity561
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

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ABOUT THIS PAGE

Pelabresib Manufacturers

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

Pelabresib Suppliers

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

Pelabresib GMP

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

Pelabresib CoA

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

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

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