rel-(2R,7aR)-2-(2-chlorophenyl)-5-oxo-N-{2-[1-(propan-2-yl)piperidin-4-yl]ethyl}hexahydro-1H-pyrrolizine-2-carboxamide
Chemical Structure Depiction of
rel-(2R,7aR)-2-(2-chlorophenyl)-5-oxo-N-{2-[1-(propan-2-yl)piperidin-4-yl]ethyl}hexahydro-1H-pyrrolizine-2-carboxamide
rel-(2R,7aR)-2-(2-chlorophenyl)-5-oxo-N-{2-[1-(propan-2-yl)piperidin-4-yl]ethyl}hexahydro-1H-pyrrolizine-2-carboxamide
Compound characteristics
| Compound ID: | SD57-0217 |
| Compound Name: | rel-(2R,7aR)-2-(2-chlorophenyl)-5-oxo-N-{2-[1-(propan-2-yl)piperidin-4-yl]ethyl}hexahydro-1H-pyrrolizine-2-carboxamide |
| Molecular Weight: | 432.01 |
| Molecular Formula: | C24 H34 Cl N3 O2 |
| Smiles: | CC(C)N1CCC(CCNC([C@@]2(C[C@@H]3CCC(N3C2)=O)c2ccccc2[Cl])=O)CC1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.0564 |
| logD: | 0.6358 |
| logSw: | -3.6371 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.824 |
| InChI Key: | CQAXHCFPKPOYRC-NTKDMRAZSA-N |