AC1MWWLT
3-benzoyl-6-[4-(diethylamino)phenyl]-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one
Also Known As: Oprea1_418010|AK-968/15361062|8-benzoyl-11-[4-(diethylamino)phenyl]-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one|3-benzoyl-6-[4-(diethylamino)phenyl]-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one|{11-[4-(diethylamino)phenyl]-1-hydroxy-3,3-dimethyl-3,4,10,11-tetrahydro-2H-dibenzo[b,e][1,4]diazepin-8-yl}(phenyl)methanone|8-benzoyl-11-(4-(diethylamino)phenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
| Molecular Formula | C32H35N3O2 |
|---|---|
| Molecular Weight | 493.27292 g/mol |
| LogP | 6.9857 |
| Topological Polar Surface Area | 61.44 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 493.27292 |
| Monoisotopic Mass | 493.27292 |
| Heavy Atoms | 37 |
| Complexity | 1352.5404 |
Chemical Identifiers
| CAS Number | 354539-05-2 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)C2C3=C(CC(CC3=O)(C)C)NC4=C(N2)C=C(C=C4)C(=O)C5=CC=CC=C5 |
Product Overview
AC1MWWLT (CAS 354539-05-2), with molecular formula C32H35N3O2 and molecular weight 493.27292 g/mol. IUPAC: 3-benzoyl-6-[4-(diethylamino)phenyl]-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one.