rel-(3R,7aS)-3-[4-(dimethylamino)phenyl]-2-(4-fluorophenyl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
Chemical Structure Depiction of
rel-(3R,7aS)-3-[4-(dimethylamino)phenyl]-2-(4-fluorophenyl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
rel-(3R,7aS)-3-[4-(dimethylamino)phenyl]-2-(4-fluorophenyl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
Compound characteristics
| Compound ID: | C466-0378 |
| Compound Name: | rel-(3R,7aS)-3-[4-(dimethylamino)phenyl]-2-(4-fluorophenyl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one |
| Molecular Weight: | 339.41 |
| Molecular Formula: | C20 H22 F N3 O |
| Smiles: | CN(C)c1ccc(cc1)[C@H]1N(C([C@@H]2CCCN12)=O)c1ccc(cc1)F |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.1679 |
| logD: | 2.8593 |
| logSw: | -3.1727 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 21.986 |
| InChI Key: | BONOHCDZWITKNP-OALUTQOASA-N |