rel-(3R,7aS)-3-(3,4-dimethoxyphenyl)-2-(4-methoxyphenyl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
Chemical Structure Depiction of
rel-(3R,7aS)-3-(3,4-dimethoxyphenyl)-2-(4-methoxyphenyl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
rel-(3R,7aS)-3-(3,4-dimethoxyphenyl)-2-(4-methoxyphenyl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
Compound characteristics
| Compound ID: | C466-0055 |
| Compound Name: | rel-(3R,7aS)-3-(3,4-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]1c1ccc(c(c1)OC)OC)=O |
| Stereo: | RELATIVE |
| logP: | 2.6634 |
| logD: | 1.369 |
| logSw: | -3.0004 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.986 |
| InChI Key: | ACKHAVYMNNJCLA-YLJYHZDGSA-N |