rel-(6R,9S)-N,N-dimethyl-11-[(3-methylphenyl)acetyl]-3-phenyl-5,6,7,8,9,10-hexahydro-6,9-epiminoimidazo[1,5-a]azocine-1-carboxamide
Chemical Structure Depiction of
rel-(6R,9S)-N,N-dimethyl-11-[(3-methylphenyl)acetyl]-3-phenyl-5,6,7,8,9,10-hexahydro-6,9-epiminoimidazo[1,5-a]azocine-1-carboxamide
rel-(6R,9S)-N,N-dimethyl-11-[(3-methylphenyl)acetyl]-3-phenyl-5,6,7,8,9,10-hexahydro-6,9-epiminoimidazo[1,5-a]azocine-1-carboxamide
Compound characteristics
| Compound ID: | SA14-1344 |
| Compound Name: | rel-(6R,9S)-N,N-dimethyl-11-[(3-methylphenyl)acetyl]-3-phenyl-5,6,7,8,9,10-hexahydro-6,9-epiminoimidazo[1,5-a]azocine-1-carboxamide |
| Molecular Weight: | 442.56 |
| Molecular Formula: | C27 H30 N4 O2 |
| Smiles: | Cc1cccc(CC(N2[C@H]3CC[C@@H]2Cn2c(C3)c(C(N(C)C)=O)nc2c2ccccc2)=O)c1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.9868 |
| logD: | 2.9868 |
| logSw: | -3.1676 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.814 |
| InChI Key: | QHELZAHJGZVODZ-FGZHOGPDSA-N |