rel-(3R,7aS)-3-(2,5-dimethoxyphenyl)-2-(4-methoxyphenyl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
Chemical Structure Depiction of
rel-(3R,7aS)-3-(2,5-dimethoxyphenyl)-2-(4-methoxyphenyl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
rel-(3R,7aS)-3-(2,5-dimethoxyphenyl)-2-(4-methoxyphenyl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
Compound characteristics
| Compound ID: | C466-0095 |
| Compound Name: | rel-(3R,7aS)-3-(2,5-dimethoxyphenyl)-2-(4-methoxyphenyl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one |
| Molecular Weight: | 368.43 |
| Molecular Formula: | C21 H24 N2 O4 |
| Smiles: | COc1ccc(cc1)N1C([C@@H]2CCCN2[C@H]1c1cc(ccc1OC)OC)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.1812 |
| logD: | 1.612 |
| logSw: | -3.2559 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.899 |
| InChI Key: | BMGPWUBXRHZYJV-UYAOXDASSA-N |