rel-(2R,7aS)-2-(3-methylphenyl)-5-oxo-N-[(pyridin-4-yl)methyl]hexahydro-1H-pyrrolizine-2-carboxamide
Chemical Structure Depiction of
rel-(2R,7aS)-2-(3-methylphenyl)-5-oxo-N-[(pyridin-4-yl)methyl]hexahydro-1H-pyrrolizine-2-carboxamide
rel-(2R,7aS)-2-(3-methylphenyl)-5-oxo-N-[(pyridin-4-yl)methyl]hexahydro-1H-pyrrolizine-2-carboxamide
Compound characteristics
| Compound ID: | SC91-0874 |
| Compound Name: | rel-(2R,7aS)-2-(3-methylphenyl)-5-oxo-N-[(pyridin-4-yl)methyl]hexahydro-1H-pyrrolizine-2-carboxamide |
| Molecular Weight: | 349.43 |
| Molecular Formula: | C21 H23 N3 O2 |
| Smiles: | Cc1cccc(c1)[C@@]1(C[C@@H]2CCC(N2C1)=O)C(NCc1ccncc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.2208 |
| logD: | 1.2174 |
| logSw: | -1.7233 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.355 |
| InChI Key: | DSEPAGWFYAWNMA-GHTZIAJQSA-N |