CAS 2052279-49-7 appears in our catalog under these names: Ibrutinib Impurity 32, Ibrutinib Impurity 108. Offered by: Chemat Brand. Available pack sizes: on request.
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 (CAS 2052279-49-7) is a chemical compound with the molecular formula C25H24N6O3 and a molecular weight of 456.5 g/mol. IUPAC name: 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. InChIKey: CXADSVNGJZSUEA-GOSISDBHSA-N.
| Molecular formula | C25H24N6O3 |
|---|---|
| Molecular weight | 456.5 g/mol |
| IUPAC name | 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 |
| InChIKey | CXADSVNGJZSUEA-GOSISDBHSA-N |
| SMILES | C=CC(=O)N1CCC[C@H](C1)N2C3=C(C(=N2)C4=CC=C(C=C4)OC5=CC=CC=C5)C(=N)N=CN3O |
Computed by PubChem (NCBI)