rel-(2R,7aS)-5-oxo-2-phenyl-N-[2-(pyridin-4-yl)ethyl]hexahydro-1H-pyrrolizine-2-carboxamide
Chemical Structure Depiction of
rel-(2R,7aS)-5-oxo-2-phenyl-N-[2-(pyridin-4-yl)ethyl]hexahydro-1H-pyrrolizine-2-carboxamide
rel-(2R,7aS)-5-oxo-2-phenyl-N-[2-(pyridin-4-yl)ethyl]hexahydro-1H-pyrrolizine-2-carboxamide
Compound characteristics
| Compound ID: | SC91-0383 |
| Compound Name: | rel-(2R,7aS)-5-oxo-2-phenyl-N-[2-(pyridin-4-yl)ethyl]hexahydro-1H-pyrrolizine-2-carboxamide |
| Molecular Weight: | 349.43 |
| Molecular Formula: | C21 H23 N3 O2 |
| Smiles: | C1C[C@H]2C[C@@](CN2C1=O)(C(NCCc1ccncc1)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.9283 |
| logD: | 0.8834 |
| logSw: | -1.4717 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.196 |
| InChI Key: | XMQCZSRWSZBWGA-GHTZIAJQSA-N |