Cambridge id 5924675
3,9,9-trimethyl-6-(4-nitrophenyl)-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one
Also Known As: Oprea1_300112|Oprea1_659071|BAS 01832381|AB00100981-01|AK-968/15359317|3,9,9-trimethyl-6-(4-nitrophenyl)-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one|3,3,8-trimethyl-11-(4-nitrophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one|11-{4-nitrophenyl}-3,3,8-trimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
| Molecular Formula | C22H23N3O3 |
|---|---|
| Molecular Weight | 377.17395 g/mol |
| LogP | 5.12512 |
| Topological Polar Surface Area | 84.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 377.17395 |
| Monoisotopic Mass | 377.17395 |
| Heavy Atoms | 28 |
| Complexity | 1006.1871 |
Chemical Identifiers
| CAS Number | 354537-36-3 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)NC3=C(C(N2)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)CC(C3)(C)C |
Product Overview
Cambridge id 5924675 (CAS 354537-36-3), with molecular formula C22H23N3O3 and molecular weight 377.17395 g/mol. IUPAC: 3,9,9-trimethyl-6-(4-nitrophenyl)-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one.
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