rel-(3R,7aS)-3-[4-(diethylamino)phenyl]-2-(3-methoxyphenyl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
Chemical Structure Depiction of
rel-(3R,7aS)-3-[4-(diethylamino)phenyl]-2-(3-methoxyphenyl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
rel-(3R,7aS)-3-[4-(diethylamino)phenyl]-2-(3-methoxyphenyl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
Compound characteristics
| Compound ID: | C466-0009 |
| Compound Name: | rel-(3R,7aS)-3-[4-(diethylamino)phenyl]-2-(3-methoxyphenyl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one |
| Molecular Weight: | 379.5 |
| Molecular Formula: | C23 H29 N3 O2 |
| Smiles: | CCN(CC)c1ccc(cc1)[C@H]1N(C([C@@H]2CCCN12)=O)c1cccc(c1)OC |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 4.0384 |
| logD: | 3.7026 |
| logSw: | -4.1312 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.4612 |
| InChI Key: | HGRYIOYJKMMKFM-FGZHOGPDSA-N |