AC1NE6ZF
5-[(6-benzoyl-1H-benzimidazol-2-yl)methyl]-6-(3,4-dichlorophenyl)-9,9-dimethyl-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one
Also Known As: 11-(3,4-dichlorophenyl)-3,3-dimethyl-10-{[5-(phenylcarbonyl)-1H-benzimidazol-2-yl]methyl}-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one|11-(3,4-dichlorophenyl)-3,3-dimethyl-10-{[5-(phenylcarbonyl)benzimidazol-2-yl] methyl}-2,3,4-trihydro-5H,11H-benzo[b]benzo[2,1-f]1,4-diazepin-1-one|5-[(6-benzoyl-1H-benzimidazol-2-yl)methyl]-6-(3,4-dichlorophenyl)-9,9-dimethyl-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one
| Molecular Formula | C36H30Cl2N4O2 |
|---|---|
| Molecular Weight | 620.17456 g/mol |
| LogP | 8.9173 |
| Topological Polar Surface Area | 78.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 620.17456 |
| Monoisotopic Mass | 620.17456 |
| Heavy Atoms | 44 |
| Complexity | 1979.0894 |
Chemical Identifiers
| CAS Number | 669751-66-0 |
|---|---|
| SMILES | CC1(CC2=C(C(N(C3=CC=CC=C3N2)CC4=NC5=C(N4)C=C(C=C5)C(=O)C6=CC=CC=C6)C7=CC(=C(C=C7)Cl)Cl)C(=O)C1)C |
Product Overview
AC1NE6ZF (CAS 669751-66-0), with molecular formula C36H30Cl2N4O2 and molecular weight 620.17456 g/mol. IUPAC: 5-[(6-benzoyl-1H-benzimidazol-2-yl)methyl]-6-(3,4-dichlorophenyl)-9,9-dimethyl-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one.