rel-(3R,7aS)-2-(1,3-thiazol-2-yl)-3-(3,4,5-trimethoxyphenyl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
Chemical Structure Depiction of
rel-(3R,7aS)-2-(1,3-thiazol-2-yl)-3-(3,4,5-trimethoxyphenyl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
rel-(3R,7aS)-2-(1,3-thiazol-2-yl)-3-(3,4,5-trimethoxyphenyl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
Compound characteristics
| Compound ID: | C466-0371 |
| Compound Name: | rel-(3R,7aS)-2-(1,3-thiazol-2-yl)-3-(3,4,5-trimethoxyphenyl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one |
| Molecular Weight: | 375.44 |
| Molecular Formula: | C18 H21 N3 O4 S |
| Smiles: | COc1cc(cc(c1OC)OC)[C@H]1N(C([C@@H]2CCCN12)=O)c1nccs1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.0232 |
| logD: | -1.3128 |
| logSw: | -2.3297 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.412 |
| InChI Key: | QAXMCCZMKUPNOC-LRDDRELGSA-N |