Chemical Compound

Ibrutinib M25

CAS Registry Number 1839090-60-6
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Ibrutinib M25 chemical structure
Primary Record

Ibrutinib M25

In stock
8,611 g
Purity
98.7 %
CAS
1839090-60-6

Compound Identifiers & Properties

CAS
1839090-60-6
PubChem CID
135390715
SMILES
C=CC(=O)NC[C@@H](CCC(=O)O)N1C2=NC=NC(=C2C(=N1)C3=CC=C(C=C3)OC4=CC=CC=C4)N
Canonical SMILES
C=CC(=O)NC[C@@H](CCC(=O)O)n1nc(-c2ccc(Oc3ccccc3)cc2)c2c(N)ncnc21

Names & Synonyms

  • Ibrutinib M25
  • Ibrutinib metabolite M25
  • 31R6NGO9QR
  • Ibrutinib Impurity 20
  • UNII-31R6NGO9QR
  • PCI-45741
  • Ibrutinib metabolite PCI-45741 (M25)
  • 1839090-60-6
  • 1H-Pyrazolo(3,4-d)pyrimidine-1-butanoic acid, 4-amino-gamma-(((1-oxo-2-propen-1-yl)amino)methyl)-3-(4-phenoxyphenyl)-, (R)-
  • 1H-PYRAZOLO(3,4-D)PYRIMIDINE-1-BUTANOIC ACID, 4-AMINO-.GAMMA.-(((1-OXO-2-PROPEN-1-YL)AMINO)METHYL)-3-(4-PHENOXYPHENYL)-, (R)-