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Chemistry

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Also known as: 1374640-70-6, Co-1686, Avl-301, Cnx-419, N-(3-((2-((4-(4-acetylpiperazin-1-yl)-2-methoxyphenyl)amino)-5-(trifluoromethyl)pyrimidin-4-yl)amino)phenyl)acrylamide, Co-1686 (avl-301)
Molecular Formula
C27H28F3N7O3
Molecular Weight
555.6  g/mol
InChI Key
HUFOZJXAKZVRNJ-UHFFFAOYSA-N
FDA UNII
72AH61702G

Rociletinib
Rociletinib is an orally available small molecule, irreversible inhibitor of epidermal growth factor receptor (EGFR) with potential antineoplastic activity. Rociletinib binds to and inhibits mutant forms of EGFR, including T790M, thereby leading to cell death of resistant tumor cells. Compared to other EGFR inhibitors, CO-1686 inhibits T790M, a secondary acquired resistance mutation, as well as other mutant EGFRs and may have therapeutic benefits in tumors with T790M-mediated resistance to other EGFR tyrosine kinase inhibitors. This agent shows minimal activity against wild-type EGFR, hence does not cause certain dose-limiting toxicities.
1 2D Structure

Rociletinib

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
N-[3-[[2-[4-(4-acetylpiperazin-1-yl)-2-methoxyanilino]-5-(trifluoromethyl)pyrimidin-4-yl]amino]phenyl]prop-2-enamide
2.1.2 InChI
InChI=1S/C27H28F3N7O3/c1-4-24(39)32-18-6-5-7-19(14-18)33-25-21(27(28,29)30)16-31-26(35-25)34-22-9-8-20(15-23(22)40-3)37-12-10-36(11-13-37)17(2)38/h4-9,14-16H,1,10-13H2,2-3H3,(H,32,39)(H2,31,33,34,35)
2.1.3 InChI Key
HUFOZJXAKZVRNJ-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC(=O)N1CCN(CC1)C2=CC(=C(C=C2)NC3=NC=C(C(=N3)NC4=CC(=CC=C4)NC(=O)C=C)C(F)(F)F)OC
2.2 Other Identifiers
2.2.1 UNII
72AH61702G
2.3 Synonyms
2.3.1 MeSH Synonyms

1. Co-1686

2.3.2 Depositor-Supplied Synonyms

1. 1374640-70-6

2. Co-1686

3. Avl-301

4. Cnx-419

5. N-(3-((2-((4-(4-acetylpiperazin-1-yl)-2-methoxyphenyl)amino)-5-(trifluoromethyl)pyrimidin-4-yl)amino)phenyl)acrylamide

6. Co-1686 (avl-301)

7. N-(3-((2-((4-(4-acetylpiperazin-1-yl)-2-methoxyphenyl)amino)-5-(trifluoromethyl)pyrimidin-4-yl)amino)phenyl)prop-2-enamide

8. Cs-1631

9. Rociletinib (co-1686)

10. 72ah61702g

11. N-[3-[[2-[4-(4-acetylpiperazin-1-yl)-2-methoxyanilino]-5-(trifluoromethyl)pyrimidin-4-yl]amino]phenyl]prop-2-enamide

12. Rociletinib (co-1686, Avl-301)

13. Co1686

14. Rociletinib [usan:inn]

15. Unii-72ah61702g

16. Rociletinib [usan]

17. Co 1686

18. Rociletinib [inn]

19. Co-1686(rociletinib)

20. Rociletinib (usan/inn)

21. Rociletinib; Co-1686

22. Rociletinib(avl-301,cnx-419,co-1686)

23. Rociletinib [who-dd]

24. Gtpl7966

25. Schembl4177736

26. Chembl3545308

27. Amy9218

28. Ex-a228

29. Bdbm149404

30. Dtxsid801025958

31. Hms3653g08

32. Bcp07085

33. Mfcd26793864

34. Nsc779405

35. Nsc783605

36. Nsc800872

37. S7284

38. Zinc98043800

39. Akos025401943

40. Akos032949985

41. Ccg-270031

42. Db11907

43. Nsc-779405

44. Nsc-783605

45. Nsc-800872

46. Sb16488

47. Ncgc00386293-08

48. Ac-27467

49. As-17009

50. Da-34963

51. Hy-15729

52. Us8975249, I-4

53. Ft-0696686

54. Sw219475-1

55. D10858

56. Q27088606

57. 2-propenamide, N-(3-((2-((4-(4-acetyl-1-piperazinyl)-2-methoxyphenyl)amino)-5-(trifluoromethyl)-4-pyrimidinyl)amino)phenyl)-

58. N-[3-[[2-[[4-(4-acetyl-1-piperazinyl)-2-methoxyphenyl]amino]-5-(trifluoromethyl)-4-pyrimidinyl]amino]phenyl]-2-propenamide

2.4 Create Date
2012-06-20
3 Chemical and Physical Properties
Molecular Weight 555.6 g/mol
Molecular Formula C27H28F3N7O3
XLogP34
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count11
Rotatable Bond Count8
Exact Mass555.22057227 g/mol
Monoisotopic Mass555.22057227 g/mol
Topological Polar Surface Area112 Ų
Heavy Atom Count40
Formal Charge0
Complexity871
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Pharmacology and Biochemistry
4.1 ATC Code

L - Antineoplastic and immunomodulating agents

L01 - Antineoplastic agents

L01E - Protein kinase inhibitors

L01EB - Epidermal growth factor receptor (egfr) tyrosine kinase inhibitors

L01EB05 - Rociletinib


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Looking for 1374640-70-6 / Rociletinib API manufacturers, exporters & distributors?

Rociletinib manufacturers, exporters & distributors 1

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PharmaCompass offers a list of Rociletinib 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 Rociletinib manufacturer or Rociletinib supplier for your needs.

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

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

API | Excipient name

Rociletinib

Synonyms

1374640-70-6, Co-1686, Avl-301, Cnx-419, N-(3-((2-((4-(4-acetylpiperazin-1-yl)-2-methoxyphenyl)amino)-5-(trifluoromethyl)pyrimidin-4-yl)amino)phenyl)acrylamide, Co-1686 (avl-301)

Cas Number

1374640-70-6

Unique Ingredient Identifier (UNII)

72AH61702G

About Rociletinib

Rociletinib is an orally available small molecule, irreversible inhibitor of epidermal growth factor receptor (EGFR) with potential antineoplastic activity. Rociletinib binds to and inhibits mutant forms of EGFR, including T790M, thereby leading to cell death of resistant tumor cells. Compared to other EGFR inhibitors, CO-1686 inhibits T790M, a secondary acquired resistance mutation, as well as other mutant EGFRs and may have therapeutic benefits in tumors with T790M-mediated resistance to other EGFR tyrosine kinase inhibitors. This agent shows minimal activity against wild-type EGFR, hence does not cause certain dose-limiting toxicities.

Rociletinib Manufacturers

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

click here to find a list of Rociletinib manufacturers with USDMF, JDMF, KDMF, CEP, GMP, COA and API Price related information on PhamaCompass.

Rociletinib Suppliers

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

click here to find a list of Rociletinib suppliers with USDMF, JDMF, KDMF, CEP, GMP, COA and API Price related information on PharmaCompass.

Rociletinib GMP

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

Rociletinib CoA

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

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

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