3,3-dimethyl-11-(4-methylphenyl)-1-oxo-N-[(oxolan-2-yl)methyl]-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepine-10-carboxamide
Chemical Structure Depiction of
3,3-dimethyl-11-(4-methylphenyl)-1-oxo-N-[(oxolan-2-yl)methyl]-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepine-10-carboxamide
3,3-dimethyl-11-(4-methylphenyl)-1-oxo-N-[(oxolan-2-yl)methyl]-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepine-10-carboxamide
Compound characteristics
| Compound ID: | J024-0185 |
| Compound Name: | 3,3-dimethyl-11-(4-methylphenyl)-1-oxo-N-[(oxolan-2-yl)methyl]-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepine-10-carboxamide |
| Molecular Weight: | 459.59 |
| Molecular Formula: | C28 H33 N3 O3 |
| Smiles: | Cc1ccc(cc1)C1C2=C(CC(C)(C)CC2=O)Nc2ccccc2N1C(NCC1CCCO1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8478 |
| logD: | 4.8258 |
| logSw: | -4.5775 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.962 |
| InChI Key: | CQKQHVPZHFWOEU-UHFFFAOYSA-N |