Products 2031255-24-8

CAS 2031255-24-8 is the registry number for Ibrutinib Impurity 49. Offered by: Chemat Brand. Available pack sizes: on request.

Ibrutinib Impurity 49
Chemat Brand
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  • Variants: 1
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Structural formula: {0} (CAS {1})

3-(4-phenoxyphenyl)-1-[(3R)-1-prop-2-enoylpiperidin-3-yl]-5H-pyrazolo[5,4-d]pyrimidin-4-one (CAS 2031255-24-8) is a chemical compound with the molecular formula C25H23N5O3 and a molecular weight of 441.5 g/mol. IUPAC name: 3-(4-phenoxyphenyl)-1-[(3R)-1-prop-2-enoylpiperidin-3-yl]-5H-pyrazolo[5,4-d]pyrimidin-4-one. InChIKey: FNJXCKUZWNTECX-GOSISDBHSA-N.

Identity
Molecular formulaC25H23N5O3
Molecular weight441.5 g/mol
IUPAC name3-(4-phenoxyphenyl)-1-[(3R)-1-prop-2-enoylpiperidin-3-yl]-5H-pyrazolo[5,4-d]pyrimidin-4-one
InChIKeyFNJXCKUZWNTECX-GOSISDBHSA-N
SMILESC=CC(=O)N1CCC[C@H](C1)N2C3=C(C(=N2)C4=CC=C(C=C4)OC5=CC=CC=C5)C(=O)NC=N3

Computed by PubChem (NCBI)

Synonyms: Ibrutinib Impurity 49, Ibrutinib Hydroxy
Isomers (same molecular formula)
3-[3-[[2-(3,4-dimethylphenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]diazenyl]-2-hydroxyphenyl]benzamide C25H23N5O3
N-[3-[[6-(4-morpholin-4-ylphenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl]oxy]phenyl]prop-2-enamide C25H23N5O3