rel-(3R,7aS)-2-(3-chlorophenyl)-3-[4-(dimethylamino)phenyl]hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
Chemical Structure Depiction of
rel-(3R,7aS)-2-(3-chlorophenyl)-3-[4-(dimethylamino)phenyl]hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
rel-(3R,7aS)-2-(3-chlorophenyl)-3-[4-(dimethylamino)phenyl]hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
Compound characteristics
| Compound ID: | C466-0285 |
| Compound Name: | rel-(3R,7aS)-2-(3-chlorophenyl)-3-[4-(dimethylamino)phenyl]hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one |
| Molecular Weight: | 355.87 |
| Molecular Formula: | C20 H22 Cl N3 O |
| Smiles: | CN(C)c1ccc(cc1)[C@H]1N(C([C@@H]2CCCN12)=O)c1cccc(c1)[Cl] |
| Stereo: | RELATIVE |
| logP: | 3.7935 |
| logD: | 3.6831 |
| logSw: | -4.392 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 21.986 |
| InChI Key: | NHRXDUPXBJYYHF-OALUTQOASA-N |