rel-(2R,7aS)-2-(4-fluorophenyl)-5-oxo-N-(pyridin-4-yl)hexahydro-1H-pyrrolizine-2-carboxamide
Chemical Structure Depiction of
rel-(2R,7aS)-2-(4-fluorophenyl)-5-oxo-N-(pyridin-4-yl)hexahydro-1H-pyrrolizine-2-carboxamide
rel-(2R,7aS)-2-(4-fluorophenyl)-5-oxo-N-(pyridin-4-yl)hexahydro-1H-pyrrolizine-2-carboxamide
Compound characteristics
| Compound ID: | SC91-0648 |
| Compound Name: | rel-(2R,7aS)-2-(4-fluorophenyl)-5-oxo-N-(pyridin-4-yl)hexahydro-1H-pyrrolizine-2-carboxamide |
| Molecular Weight: | 339.37 |
| Molecular Formula: | C19 H18 F N3 O2 |
| Smiles: | C1C[C@H]2C[C@@](CN2C1=O)(C(Nc1ccncc1)=O)c1ccc(cc1)F |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.8247 |
| logD: | 1.7467 |
| logSw: | -2.1949 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.033 |
| InChI Key: | HKDFBUBJAZTDFL-QFBILLFUSA-N |