3-(10-benzoyl-3,3-dimethyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl)phenyl acetate
Chemical Structure Depiction of
3-(10-benzoyl-3,3-dimethyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl)phenyl acetate
3-(10-benzoyl-3,3-dimethyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl)phenyl acetate
Compound characteristics
| Compound ID: | 3046-8851 |
| Compound Name: | 3-(10-benzoyl-3,3-dimethyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl)phenyl acetate |
| Molecular Weight: | 480.56 |
| Molecular Formula: | C30 H28 N2 O4 |
| Smiles: | CC(=O)Oc1cccc(c1)C1C2=C(CC(C)(C)CC2=O)Nc2ccccc2N1C(c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8021 |
| logD: | 4.7747 |
| logSw: | -4.6832 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.916 |
| InChI Key: | QDDJSEAYBYPIGH-NDEPHWFRSA-N |