rel-(3R,7aS)-3-(3,4-dichlorophenyl)-2-(1,3-thiazol-2-yl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
Chemical Structure Depiction of
rel-(3R,7aS)-3-(3,4-dichlorophenyl)-2-(1,3-thiazol-2-yl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
rel-(3R,7aS)-3-(3,4-dichlorophenyl)-2-(1,3-thiazol-2-yl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
Compound characteristics
| Compound ID: | C466-0367 |
| Compound Name: | rel-(3R,7aS)-3-(3,4-dichlorophenyl)-2-(1,3-thiazol-2-yl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one |
| Molecular Weight: | 354.26 |
| Molecular Formula: | C15 H13 Cl2 N3 O S |
| Smiles: | C1C[C@H]2C(N(c3nccs3)[C@H](c3ccc(c(c3)[Cl])[Cl])N2C1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.7607 |
| logD: | 3.5558 |
| logSw: | -4.1888 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.4337 |
| InChI Key: | IIFBFALIGGKRDZ-STQMWFEESA-N |