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Chemistry

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Also known as: Mln4924, Mln-4924, 905579-51-3, Mln 4924, Pevonedistat (mln-4924), ((1s,2s,4r)-4-(4-(((s)-2,3-dihydro-1h-inden-1-yl)amino)-7h-pyrrolo[2,3-d]pyrimidin-7-yl)-2-hydroxycyclopentyl)methyl sulfamate
Molecular Formula
C21H25N5O4S
Molecular Weight
443.5  g/mol
InChI Key
MPUQHZXIXSTTDU-QXGSTGNESA-N
FDA UNII
S3AZD8D215

Pevonedistat
Pevonedistat is a small molecule inhibitor of Nedd8 activating enzyme (NAE) with potential antineoplastic activity. Pevonedistat binds to and inhibits NAE, which may result in the inhibition of tumor cell proliferation and survival. NAE activates Nedd8 (Neural precursor cell expressed, developmentally down-regulated 8), an ubiquitin-like (UBL) protein that modifies cellular targets in a pathway that is parallel to but distinct from the ubiquitin-proteasome pathway (UPP). Functioning in diverse regulatory activities, proteins conjugated to UBLs like Nedd8 typically are not targeted for proteasomal degradation.
1 2D Structure

Pevonedistat

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
[(1S,2S,4R)-4-[4-[[(1S)-2,3-dihydro-1H-inden-1-yl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]-2-hydroxycyclopentyl]methyl sulfamate
2.1.2 InChI
InChI=1S/C21H25N5O4S/c22-31(28,29)30-11-14-9-15(10-19(14)27)26-8-7-17-20(23-12-24-21(17)26)25-18-6-5-13-3-1-2-4-16(13)18/h1-4,7-8,12,14-15,18-19,27H,5-6,9-11H2,(H2,22,28,29)(H,23,24,25)/t14-,15+,18-,19-/m0/s1
2.1.3 InChI Key
MPUQHZXIXSTTDU-QXGSTGNESA-N
2.1.4 Canonical SMILES
C1CC2=CC=CC=C2C1NC3=C4C=CN(C4=NC=N3)C5CC(C(C5)O)COS(=O)(=O)N
2.1.5 Isomeric SMILES
C1CC2=CC=CC=C2[C@H]1NC3=C4C=CN(C4=NC=N3)[C@@H]5C[C@H]([C@H](C5)O)COS(=O)(=O)N
2.2 Other Identifiers
2.2.1 UNII
S3AZD8D215
2.3 Synonyms
2.3.1 MeSH Synonyms

1. ((1s,2s,4r)-4-(4-((1s)-2,3-dihydro-1h-inden-1-ylamino)-7h-pyrrolo(2,3-d)pyrimidin-7-yl)-2-hydroxycyclopentyl)methyl Sulfamate

2. ((1s,2s,4r)-4-(4-((1s)-2,3-dihydro-1h-inden-1-ylamino)-7h-pyrrolo(2,3-d)pyrimidin-7-yl)-2-hydroxycyclopentyl)methyl Sulphamate

3. 4-(4-((1s)-2,3-dihydro-1h-inden-1-ylamino)-7h-pyrrolo(2,3-d)pyrimidin-7-yl)-2-hydroxycyclopentyl Methyl Sulfamidate

4. Mln-4924

5. Mln4924

2.3.2 Depositor-Supplied Synonyms

1. Mln4924

2. Mln-4924

3. 905579-51-3

4. Mln 4924

5. Pevonedistat (mln-4924)

6. ((1s,2s,4r)-4-(4-(((s)-2,3-dihydro-1h-inden-1-yl)amino)-7h-pyrrolo[2,3-d]pyrimidin-7-yl)-2-hydroxycyclopentyl)methyl Sulfamate

7. Mln-4924003

8. S3azd8d215

9. 905579-51-3 (free Base)

10. Pevonedistat (usan)

11. Pevonedistat [usan]

12. [(1s,2s,4r)-4-{4-[(1s)-2,3-dihydro-1h-inden-1-ylamino]-7h-pyrrolo[2,3-d]pyrimidin-7-yl}-2-hydroxycyclopentyl]methyl Sulfamate

13. Sulfamic Acid [(1s,2s,4r)-4-[4-[[(1s)-2,3-dihydro-1h-inden-1-yl]amino]-7h-pyrrolo[2,3-d]pyrimidin-7-yl]-2-hydroxycyclopentyl]methyl Ester

14. ((1s,2s,4r)-4-(4-((1s)-2,3-dihydro-1h-inden-1-ylamino)-7h-pyrrolo(2,3-d)pyrimidin-7-yl)-2-hydroxycyclopentyl)methyl Sulfamate

15. Sulfamic Acid, ((1s,2s,4r)-4-(4-(((1s)-2,3-dihydro-1h-inden-1-yl)amino)-7h-pyrrolo(2,3-d)pyrimidin-7-yl)-2-hydroxycyclopentyl)methyl Ester

16. Pevonedistat [usan:inn]

17. Pevonedistatum

18. Unii-s3azd8d215

19. 3gzn

20. ((1s,2s,4r)-4-{4-[(1s)-2,3-dihydro-1h-inden-1-ylamino]-7h-pyrrolo[2,3-d]pyrimidin-7-yl}-2-hydroxycyclopentyl)methyl Sulfamate

21. B39

22. Pevonedistat; Mln4924

23. Pevonedistat [inn]

24. ((1s,2s,4r)-4-(4-((1s)-2,3-dihydro-1h-inden-1-ylamino)-7h-pyrrolo(2,3-d)pyrimidin-7-yl)-2-hydroxycyclopentyl)methyl Sulphamate

25. Mls006010830

26. Pevonedistat [who-dd]

27. Schembl192875

28. Tak924

29. Chembl1231160

30. Chebi:95028

31. Gtpl12117

32. Tak-924

33. Chebi:145535

34. Dtxsid701022549

35. Ex-a1472

36. Bdbm50285607

37. Nsc793435

38. Zinc58660702

39. Akos025401927

40. Cs-0348

41. Db11759

42. Nsc-793435

43. Ncgc00345794-02

44. Ncgc00345794-07

45. Ncgc00345794-10

46. [(1s,2s,4r)-4-[4-[[(1s)-2,3-dihydro-1h-inden-1-yl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]-2-hydroxycyclopentyl]methyl Sulfamate

47. [(1s,2s,4r)-4-{4-[(1s)-2,3-dihydro-1h-inden-1-ylamino]-7h-pyrrolo [2,3-d]pyrimidin-7-yl}-2-hydroxycyclopentyl]methyl Sulfamate

48. 4-(4-((1s)-2,3-dihydro-1h-inden-1-ylamino)-7h-pyrrolo(2,3-d)pyrimidin-7-yl)-2-hydroxycyclopentyl Methyl Sulfamidate

49. Ac-27394

50. Hy-70062

51. Smr004701757

52. D10413

53. Brd-k67844266-001-01-3

54. Q27166792

55. ((1s,2s,4r)-4-(4-(((1s)-2,3-dihydro-1h-inden-1-yl)amino(-7h-pyrrolo(2,3-d)pyrimidin-7-yl)-2-hydroxycyclopentyl)methyl Sulfamate

56. ((1s,2s,4r)-4-(4-((s)-2,3-dihydro-1h-inden-1-ylamino)-7h-pyrrolo[2,3-d]pyrimidin-7-yl)-2-hydroxycyclopentyl)methyl Sulfamate

57. ((1s,2s,4r)-4-{4-[(1s)-2,3-dihydro-1h-inden-1-ylamino]-7h-pyrrolo[2,3-d]-pyrimidin-7-yl}-2-hydroxycyclopentyl)methyl Sulfamate

58. [(1s,2s,4r)-4-[4-[[(1s)-2,3-dihydro-1h-inden-1-yl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]-2-hydroxy-cyclopentyl]methyl Sulfamate

2.4 Create Date
2007-08-27
3 Chemical and Physical Properties
Molecular Weight 443.5 g/mol
Molecular Formula C21H25N5O4S
XLogP31.7
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count6
Exact Mass443.16272547 g/mol
Monoisotopic Mass443.16272547 g/mol
Topological Polar Surface Area141 Ų
Heavy Atom Count31
Formal Charge0
Complexity734
Isotope Atom Count0
Defined Atom Stereocenter Count4
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 acute myeloid leukaemia, Treatment of myelodysplastic syndromes


5 Pharmacology and Biochemistry
5.1 MeSH Pharmacological Classification

Enzyme Inhibitors

Compounds or agents that combine with an enzyme in such a manner as to prevent the normal substrate-enzyme combination and the catalytic reaction. (See all compounds classified as Enzyme Inhibitors.)


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Looking for 905579-51-3 / Pevonedistat API manufacturers, exporters & distributors?

Pevonedistat manufacturers, exporters & distributors 1

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

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

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

API | Excipient name

Pevonedistat

Synonyms

Mln4924, Mln-4924, 905579-51-3, Mln 4924, Pevonedistat (mln-4924), ((1s,2s,4r)-4-(4-(((s)-2,3-dihydro-1h-inden-1-yl)amino)-7h-pyrrolo[2,3-d]pyrimidin-7-yl)-2-hydroxycyclopentyl)methyl sulfamate

Cas Number

905579-51-3

Unique Ingredient Identifier (UNII)

S3AZD8D215

About Pevonedistat

Pevonedistat is a small molecule inhibitor of Nedd8 activating enzyme (NAE) with potential antineoplastic activity. Pevonedistat binds to and inhibits NAE, which may result in the inhibition of tumor cell proliferation and survival. NAE activates Nedd8 (Neural precursor cell expressed, developmentally down-regulated 8), an ubiquitin-like (UBL) protein that modifies cellular targets in a pathway that is parallel to but distinct from the ubiquitin-proteasome pathway (UPP). Functioning in diverse regulatory activities, proteins conjugated to UBLs like Nedd8 typically are not targeted for proteasomal degradation.

Pevonedistat Manufacturers

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

Pevonedistat Suppliers

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

Pevonedistat GMP

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

Pevonedistat CoA

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

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

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