rel-(3R,7aS)-3-(2,5-dimethoxyphenyl)-2-(pyridin-2-yl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
Chemical Structure Depiction of
rel-(3R,7aS)-3-(2,5-dimethoxyphenyl)-2-(pyridin-2-yl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
rel-(3R,7aS)-3-(2,5-dimethoxyphenyl)-2-(pyridin-2-yl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
Compound characteristics
| Compound ID: | C466-0190 |
| Compound Name: | rel-(3R,7aS)-3-(2,5-dimethoxyphenyl)-2-(pyridin-2-yl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one |
| Molecular Weight: | 339.39 |
| Molecular Formula: | C19 H21 N3 O3 |
| Smiles: | COc1ccc(c(c1)[C@H]1N(C([C@@H]2CCCN12)=O)c1ccccn1)OC |
| Stereo: | RELATIVE |
| logP: | 2.6729 |
| logD: | 0.7076 |
| logSw: | -2.9187 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.867 |
| InChI Key: | XQKIBLLDJIMZII-CRAIPNDOSA-N |