rel-(3R,7aS)-3-(3-methoxyphenyl)-2-(1,3-thiazol-2-yl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
Chemical Structure Depiction of
rel-(3R,7aS)-3-(3-methoxyphenyl)-2-(1,3-thiazol-2-yl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
rel-(3R,7aS)-3-(3-methoxyphenyl)-2-(1,3-thiazol-2-yl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
Compound characteristics
| Compound ID: | C466-0363 |
| Compound Name: | rel-(3R,7aS)-3-(3-methoxyphenyl)-2-(1,3-thiazol-2-yl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one |
| Molecular Weight: | 315.39 |
| Molecular Formula: | C16 H17 N3 O2 S |
| Smiles: | COc1cccc(c1)[C@H]1N(C([C@@H]2CCCN12)=O)c1nccs1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.3136 |
| logD: | 0.1605 |
| logSw: | -2.6418 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.978 |
| InChI Key: | XEOSKOVWOFNURP-KBPBESRZSA-N |