Products 2437254-47-0

CAS 2437254-47-0 appears in our catalog under these names: Ibrutinib Impurity 31, (R)-1-(1-Acryloylpiperidin-3-yl)-4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidine 5-oxide 95%. Offered by: Chemat Brand, Ambeed. Available pack sizes: on request, 1mg, 5mg, 10mg, 25mg.

Ibrutinib Impurity 31
Chemat Brand
  • size: on request
  • Variants: 1
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(R)-1-(1-Acryloylpiperidin-3-yl)-4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidine 5-oxide 95%
Ambeed
  • size: 1mg, 5mg, 10mg, 25mg
  • Variants: 4
from 442.69
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Structural formula: {0} (CAS {1})

1-[(3R)-3-[5-hydroxy-4-imino-3-(4-phenoxyphenyl)pyrazolo[5,4-d]pyrimidin-1-yl]piperidin-1-yl]prop-2-en-1-one (CAS 2437254-47-0) is a chemical compound with the molecular formula C25H24N6O3 and a molecular weight of 456.5 g/mol. IUPAC name: 1-[(3R)-3-[5-hydroxy-4-imino-3-(4-phenoxyphenyl)pyrazolo[5,4-d]pyrimidin-1-yl]piperidin-1-yl]prop-2-en-1-one. InChIKey: OIZIQPXPDWYSJD-GOSISDBHSA-N.

Identity
Molecular formulaC25H24N6O3
Molecular weight456.5 g/mol
IUPAC name1-[(3R)-3-[5-hydroxy-4-imino-3-(4-phenoxyphenyl)pyrazolo[5,4-d]pyrimidin-1-yl]piperidin-1-yl]prop-2-en-1-one
InChIKeyOIZIQPXPDWYSJD-GOSISDBHSA-N
SMILESC=CC(=O)N1CCC[C@H](C1)N2C3=C(C(=N2)C4=CC=C(C=C4)OC5=CC=CC=C5)C(=N)N(C=N3)O

Computed by PubChem (NCBI)

Synonyms: Ibrutinib Impurity 44, Ibrutinib N1-Oxide
Isomers (same molecular formula)
1-[(3R)-3-[7-hydroxy-4-imino-3-(4-phenoxyphenyl)pyrazolo[5,4-d]pyrimidin-1-yl]piperidin-1-yl]prop-2-en-1-one C25H24N6O3
1-[(3R)-3-[(1R)-4-amino-1-oxido-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-1-ium-1-yl]piperidin-1-yl]prop-2-en-1-one C25H24N6O3
1-[(3R)-3-[(1S)-4-amino-1-oxido-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-1-ium-1-yl]piperidin-1-yl]prop-2-en-1-one C25H24N6O3
1-[3-[4-amino-3-[4-(4-hydroxyphenoxy)phenyl]pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl]prop-2-en-1-one C25H24N6O3