CAS 2031255-25-9 appears in our catalog under these names: Ibrutinib Impurity 37, (S)-1-((R)-1-Acryloylpiperidin-3-yl)-4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidine 1-oxide (Ibrutinib Impurity), 98%, 98%, (S)-1-((R)-1-Acryloylpiperidin-3-yl)-4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidine 1-oxide (Ibrutinib Impurity), 98%. Offered by: Chemat Brand, Chemat, Fluorochem. Available pack sizes: on request, 50mg.
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 (CAS 2031255-25-9) is a chemical compound with the molecular formula C25H24N6O3 and a molecular weight of 456.5 g/mol. IUPAC name: 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. InChIKey: WHNVUBNAXFVNTG-WTPASJBYSA-N.
| Molecular formula | C25H24N6O3 |
|---|---|
| Molecular weight | 456.5 g/mol |
| IUPAC name | 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 |
| InChIKey | WHNVUBNAXFVNTG-WTPASJBYSA-N |
| SMILES | C=CC(=O)N1CCC[C@H](C1)[N@+]2(C3=NC=NC(=C3C(=N2)C4=CC=C(C=C4)OC5=CC=CC=C5)N)[O-] |
Computed by PubChem (NCBI)