rel-(6R,9S)-11-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,N-dimethyl-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)-11-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,N-dimethyl-3-phenyl-5,6,7,8,9,10-hexahydro-6,9-epiminoimidazo[1,5-a]azocine-1-carboxamide
rel-(6R,9S)-11-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,N-dimethyl-3-phenyl-5,6,7,8,9,10-hexahydro-6,9-epiminoimidazo[1,5-a]azocine-1-carboxamide
Compound characteristics
| Compound ID: | SA14-1320 |
| Compound Name: | rel-(6R,9S)-11-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,N-dimethyl-3-phenyl-5,6,7,8,9,10-hexahydro-6,9-epiminoimidazo[1,5-a]azocine-1-carboxamide |
| Molecular Weight: | 419.53 |
| Molecular Formula: | C24 H29 N5 O2 |
| Smiles: | Cc1c(CN2[C@H]3CC[C@@H]2Cn2c(C3)c(C(N(C)C)=O)nc2c2ccccc2)c(C)on1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.9302 |
| logD: | 1.9281 |
| logSw: | -2.3443 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.795 |
| InChI Key: | NOWRJERFJVULTC-RTBURBONSA-N |