Chemical Compound

IBRUTINIB IMPURITY 91

CAS Registry Number 1839099-22-7
IBRUTINIB IMPURITY 91 chemical structure
Primary Record

IBRUTINIB IMPURITY 91

In stock
9,982 g
Purity
98.1 %
CAS
1839099-22-7

Compound Identifiers & Properties

CAS
1839099-22-7
PubChem CID
58369202
SMILES
CCC(=O)N1CCCC(C1)N2C3=NC=NC(=C3C(=N2)C4=CC=C(C=C4)OC5=CC=CC=C5)N
Canonical SMILES
CCC(=O)N1CCCC(n2nc(-c3ccc(Oc4ccccc4)cc3)c3c(N)ncnc32)C1

Names & Synonyms

  • IBRUTINIB IMPURITY 91
  • Ibrutinib N-Propionyl Analog
  • SCHEMBL11948322
  • (R)-N-Desacryloyl N-Propionyl Ibrutinib
  • PYC09922
  • 1839099-22-7
  • rac-N-Desacryloyl N-Propionyl Ibrutinib
  • 1-[3-[4-amino-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl]propan-1-one
  • G87619
  • 1-Propanone, 1-[(3R)-3-[4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]-1-piperidinyl]-
  • (R)-1-(3-(4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidin-1-yl)propan-1-one
  • 1-(3-(4-Amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidin-1-yl)propan-1-one
  • 1-[(3R)-3-[4-Amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]-1-piperidinyl]-1-propanone