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Substance Name: BVB-808
RN: 1414587-22-6
UNII: M4AC149ZE3
InChIKey: VIIPVCPPCBLRRL-BGYRXZFFSA-N

Molecular Formula

  • C29-H33-F2-N7-O

Molecular Weight

  • 533.6237
 
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Names and Synonyms

Name of Substance

  • BVB-808

Synonyms

  • 7-(3,5-Difluoro-4-(morpholinomethyl)phenyl)-N-(4-((3R,5S)-3,5-dimethylpiperazin-1-yl)phenyl)-7H-pyrrolo(2,3-d)pyrimidin-2-amine, rel
  • 7-(3,5-Difluoro-4-(morpholinomethyl)phenyl)-N-(4-(cis-3,5-dimethylpiperazin-1-yl)phenyl)-7H-pyrrolo(2,3-d)pyrimidin-2-amine
  • 7H-Pyrrolo(2,3-d)pyrimidin-2-amine, 7-(3,5-difluoro-4-(4-morpholinylmethyl)phenyl)-N-(4-((3R,5S)-3,5-dimethyl-1-piperazinyl)phenyl)-
  • BVB-808
  • BVB808
  • NVP-BVB-808
  • NVP-BVB808
  • UNII-M4AC149ZE3

Registry Numbers

CAS Registry Number

  • 1414587-22-6

FDA UNII

  • M4AC149ZE3

System Generated Number

  • 1414587226

Structure Descriptors

InChI

1S/C29H33F2N7O/c1-19-16-37(17-20(2)33-19)23-5-3-22(4-6-23)34-29-32-15-21-7-8-38(28(21)35-29)24-13-26(30)25(27(31)14-24)18-36-9-11-39-12-10-36/h3-8,13-15,19-20,33H,9-12,16-18H2,1-2H3,(H,32,34,35)/t19-,20+

InChIKey

VIIPVCPPCBLRRL-BGYRXZFFSA-N

Smiles

C[C@@H]1CN(C[C@@H](N1)C)c2ccc(cc2)Nc3ncc4ccn(c4n3)c5cc(c(c(c5)F)CN6CCOCC6)F