rel-(2R,7aS)-2-(3-methoxyphenyl)-5-oxo-N-[(pyridin-4-yl)methyl]hexahydro-1H-pyrrolizine-2-carboxamide
Chemical Structure Depiction of
rel-(2R,7aS)-2-(3-methoxyphenyl)-5-oxo-N-[(pyridin-4-yl)methyl]hexahydro-1H-pyrrolizine-2-carboxamide
rel-(2R,7aS)-2-(3-methoxyphenyl)-5-oxo-N-[(pyridin-4-yl)methyl]hexahydro-1H-pyrrolizine-2-carboxamide
Compound characteristics
| Compound ID: | SC91-0451 |
| Compound Name: | rel-(2R,7aS)-2-(3-methoxyphenyl)-5-oxo-N-[(pyridin-4-yl)methyl]hexahydro-1H-pyrrolizine-2-carboxamide |
| Molecular Weight: | 365.43 |
| Molecular Formula: | C21 H23 N3 O3 |
| Smiles: | COc1cccc(c1)[C@@]1(C[C@@H]2CCC(N2C1)=O)C(NCc1ccncc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.9119 |
| logD: | 0.9085 |
| logSw: | -1.579 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.899 |
| InChI Key: | FISZUVYZGFEMCR-LAUBAEHRSA-N |