rel-(6R,9S)-N-methyl-11-[(morpholin-4-yl)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-methyl-11-[(morpholin-4-yl)acetyl]-3-phenyl-5,6,7,8,9,10-hexahydro-6,9-epiminoimidazo[1,5-a]azocine-1-carboxamide
rel-(6R,9S)-N-methyl-11-[(morpholin-4-yl)acetyl]-3-phenyl-5,6,7,8,9,10-hexahydro-6,9-epiminoimidazo[1,5-a]azocine-1-carboxamide
Compound characteristics
| Compound ID: | SA14-1246 |
| Compound Name: | rel-(6R,9S)-N-methyl-11-[(morpholin-4-yl)acetyl]-3-phenyl-5,6,7,8,9,10-hexahydro-6,9-epiminoimidazo[1,5-a]azocine-1-carboxamide |
| Molecular Weight: | 423.51 |
| Molecular Formula: | C23 H29 N5 O3 |
| Smiles: | CNC(c1c2C[C@@H]3CC[C@H](Cn2c(c2ccccc2)n1)N3C(CN1CCOCC1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.2225 |
| logD: | 0.2145 |
| logSw: | -1.9188 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.561 |
| InChI Key: | KTLSEWSNOSTRIQ-QZTJIDSGSA-N |