rel-(2R,7aS)-N-{3-[(1-ethylpiperidin-4-yl)oxy]propyl}-2-(4-fluorophenyl)-5-oxohexahydro-1H-pyrrolizine-2-carboxamide
Chemical Structure Depiction of
rel-(2R,7aS)-N-{3-[(1-ethylpiperidin-4-yl)oxy]propyl}-2-(4-fluorophenyl)-5-oxohexahydro-1H-pyrrolizine-2-carboxamide
rel-(2R,7aS)-N-{3-[(1-ethylpiperidin-4-yl)oxy]propyl}-2-(4-fluorophenyl)-5-oxohexahydro-1H-pyrrolizine-2-carboxamide
Compound characteristics
| Compound ID: | SC91-0671 |
| Compound Name: | rel-(2R,7aS)-N-{3-[(1-ethylpiperidin-4-yl)oxy]propyl}-2-(4-fluorophenyl)-5-oxohexahydro-1H-pyrrolizine-2-carboxamide |
| Molecular Weight: | 431.55 |
| Molecular Formula: | C24 H34 F N3 O3 |
| Smiles: | CCN1CCC(CC1)OCCCNC([C@]1(C[C@@H]2CCC(N2C1)=O)c1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.4135 |
| logD: | -0.9888 |
| logSw: | -2.2262 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.429 |
| InChI Key: | DNGIIPBQTZBYAJ-RDPSFJRHSA-N |