rel-(6R,9S)-N,N-dimethyl-11-[(4-methyl-1,3-thiazol-5-yl)methyl]-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-[(4-methyl-1,3-thiazol-5-yl)methyl]-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-[(4-methyl-1,3-thiazol-5-yl)methyl]-3-phenyl-5,6,7,8,9,10-hexahydro-6,9-epiminoimidazo[1,5-a]azocine-1-carboxamide
Compound characteristics
| Compound ID: | SA14-1298 |
| Compound Name: | rel-(6R,9S)-N,N-dimethyl-11-[(4-methyl-1,3-thiazol-5-yl)methyl]-3-phenyl-5,6,7,8,9,10-hexahydro-6,9-epiminoimidazo[1,5-a]azocine-1-carboxamide |
| Molecular Weight: | 421.56 |
| Molecular Formula: | C23 H27 N5 O S |
| Smiles: | Cc1c(CN2[C@H]3CC[C@@H]2Cn2c(C3)c(C(N(C)C)=O)nc2c2ccccc2)scn1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.1133 |
| logD: | 2.1132 |
| logSw: | -2.5656 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.962 |
| InChI Key: | YGGUAZPBAWFUHW-MSOLQXFVSA-N |