AC1LKFKE
16-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-1,8-diazatetracyclo[7.7.0.02,7.011,15]hexadeca-2,4,6,8,10,15-hexaene-10-carbonitrile
Also Known As: Oprea1_562585|Oprea1_591803|BAS 00312800|11-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]-2,3-dihydro-1H-cyclopenta[4,5]pyrido[1,2-a]benzimidazole-4-carbonitrile|AF-399/36011059|SR-01000433895-1|11-((1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino)-2,3-dihydro-1H-benzo[4,5]imidazo[1,2-a]cyclopenta[d]pyridine-4-carbonitrile|16-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-1,8-diazatetracyclo[7.7.0.02,7.011,15]hexadeca-2,4,6,8,10,15-hexaene-10-carbonitrile|4-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-ylamino)-2,3-dihydro-1H-4a,9-diaza-cyclopenta[b]fluorene-10-carbonitrile
| Molecular Formula | C26H22N6O |
|---|---|
| Molecular Weight | 434.18552 g/mol |
| LogP | 4.3893 |
| Topological Polar Surface Area | 80.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 434.18552 |
| Monoisotopic Mass | 434.18552 |
| Heavy Atoms | 33 |
| Complexity | 1663.3075 |
Chemical Identifiers
| CAS Number | 305331-91-3 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=C4CCCC4=C(C5=NC6=CC=CC=C6N35)C#N |
Product Overview
AC1LKFKE (CAS 305331-91-3), with molecular formula C26H22N6O and molecular weight 434.18552 g/mol. IUPAC: 16-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-1,8-diazatetracyclo[7.7.0.02,7.011,15]hexadeca-2,4,6,8,10,15-hexaene-10-carbonitrile.