| Identification | Back Directory | [Name]
2-Propen-1-one, 1-[(3R)-3-[4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]-1-piperidinyl]-2-methyl- | [CAS]
2797253-43-9 | [Synonyms]
(R)-1-(3-(4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidin-1-yl)-2-methylprop-2-en-1-one
2-Propen-1-one, 1-[(3R)-3-[4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]-1-piperidinyl]-2-methyl-
(R)-1-(3-(4-Amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidin-1-yl)-2-methylprop-2-en-1-one (Ibrutinib Impurity) | [Molecular Formula]
C26H26N6O2 | [MOL File]
2797253-43-9.mol | [Molecular Weight]
454.53 |
| Chemical Properties | Back Directory | [Boiling point ]
721.8±60.0 °C(Predicted) | [density ]
1.32±0.1 g/cm3(Predicted) | [pka]
4.09±0.30(Predicted) | [InChIKey]
SVIZVWRMNNDHOC-DETXXQSHNA-N | [SMILES]
NC1N=CN=C2N([C@@H]3CCCN(C(=O)C(=C)C)C3)N=C(C3C=CC(OC4C=CC=CC=4)=CC=3)C=12 |&1:7,r| |
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