rel-(3R,7aS)-2-(4-methoxyphenyl)-3-(thiophen-2-yl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
Chemical Structure Depiction of
rel-(3R,7aS)-2-(4-methoxyphenyl)-3-(thiophen-2-yl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
rel-(3R,7aS)-2-(4-methoxyphenyl)-3-(thiophen-2-yl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
Compound characteristics
| Compound ID: | C466-0097 |
| Compound Name: | rel-(3R,7aS)-2-(4-methoxyphenyl)-3-(thiophen-2-yl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one |
| Molecular Weight: | 314.4 |
| Molecular Formula: | C17 H18 N2 O2 S |
| Smiles: | COc1ccc(cc1)N1C([C@@H]2CCCN2[C@H]1c1cccs1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.625 |
| logD: | 2.6186 |
| logSw: | -2.8078 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.7434 |
| InChI Key: | WSGCITCDIYWVOQ-HOCLYGCPSA-N |