rel-(2R,7aS)-N-(2,2-difluoroethyl)-2-(4-fluorophenyl)-5-oxohexahydro-1H-pyrrolizine-2-carboxamide
Chemical Structure Depiction of
rel-(2R,7aS)-N-(2,2-difluoroethyl)-2-(4-fluorophenyl)-5-oxohexahydro-1H-pyrrolizine-2-carboxamide
rel-(2R,7aS)-N-(2,2-difluoroethyl)-2-(4-fluorophenyl)-5-oxohexahydro-1H-pyrrolizine-2-carboxamide
Compound characteristics
| Compound ID: | SC91-0633 |
| Compound Name: | rel-(2R,7aS)-N-(2,2-difluoroethyl)-2-(4-fluorophenyl)-5-oxohexahydro-1H-pyrrolizine-2-carboxamide |
| Molecular Weight: | 326.32 |
| Molecular Formula: | C16 H17 F3 N2 O2 |
| Smiles: | C1C[C@H]2C[C@@](CN2C1=O)(C(NCC(F)F)=O)c1ccc(cc1)F |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.1325 |
| logD: | 1.1319 |
| logSw: | -2.1587 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.198 |
| InChI Key: | FOMLEBMSINLELG-BLLLJJGKSA-N |