rel-(6R,9S)-N,N-dimethyl-11-[(5-methylthiophen-2-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-[(5-methylthiophen-2-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-[(5-methylthiophen-2-yl)methyl]-3-phenyl-5,6,7,8,9,10-hexahydro-6,9-epiminoimidazo[1,5-a]azocine-1-carboxamide
Compound characteristics
| Compound ID: | SA14-1913 |
| Compound Name: | rel-(6R,9S)-N,N-dimethyl-11-[(5-methylthiophen-2-yl)methyl]-3-phenyl-5,6,7,8,9,10-hexahydro-6,9-epiminoimidazo[1,5-a]azocine-1-carboxamide |
| Molecular Weight: | 420.58 |
| Molecular Formula: | C24 H28 N4 O S |
| Smiles: | Cc1ccc(CN2[C@H]3CC[C@@H]2Cn2c(C3)c(C(N(C)C)=O)nc2c2ccccc2)s1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.1779 |
| logD: | 3.1776 |
| logSw: | -3.0657 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 30.7752 |
| InChI Key: | PERFQWXCMAAIBB-MOPGFXCFSA-N |