rel-(2R,7aS)-N-[(2-chlorophenyl)methyl]-2-(3-methoxyphenyl)-5-oxohexahydro-1H-pyrrolizine-2-carboxamide
Chemical Structure Depiction of
rel-(2R,7aS)-N-[(2-chlorophenyl)methyl]-2-(3-methoxyphenyl)-5-oxohexahydro-1H-pyrrolizine-2-carboxamide
rel-(2R,7aS)-N-[(2-chlorophenyl)methyl]-2-(3-methoxyphenyl)-5-oxohexahydro-1H-pyrrolizine-2-carboxamide
Compound characteristics
| Compound ID: | SC91-1043 |
| Compound Name: | rel-(2R,7aS)-N-[(2-chlorophenyl)methyl]-2-(3-methoxyphenyl)-5-oxohexahydro-1H-pyrrolizine-2-carboxamide |
| Molecular Weight: | 398.89 |
| Molecular Formula: | C22 H23 Cl N2 O3 |
| Smiles: | COc1cccc(c1)[C@@]1(C[C@@H]2CCC(N2C1)=O)C(NCc1ccccc1[Cl])=O |
| Stereo: | RELATIVE |
| logP: | 3.0505 |
| logD: | 3.0504 |
| logSw: | -3.577 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.47 |
| InChI Key: | ZIKIFCOAJRNERU-HTAPYJJXSA-N |