rel-(2R,7aS)-N-[(1H-benzimidazol-2-yl)methyl]-2-(2-chlorophenyl)-5-oxohexahydro-1H-pyrrolizine-2-carboxamide
Chemical Structure Depiction of
rel-(2R,7aS)-N-[(1H-benzimidazol-2-yl)methyl]-2-(2-chlorophenyl)-5-oxohexahydro-1H-pyrrolizine-2-carboxamide
rel-(2R,7aS)-N-[(1H-benzimidazol-2-yl)methyl]-2-(2-chlorophenyl)-5-oxohexahydro-1H-pyrrolizine-2-carboxamide
Compound characteristics
| Compound ID: | SC91-0526 |
| Compound Name: | rel-(2R,7aS)-N-[(1H-benzimidazol-2-yl)methyl]-2-(2-chlorophenyl)-5-oxohexahydro-1H-pyrrolizine-2-carboxamide |
| Molecular Weight: | 408.89 |
| Molecular Formula: | C22 H21 Cl N4 O2 |
| Smiles: | C1C[C@H]2C[C@@](CN2C1=O)(C(NCc1nc2ccccc2[nH]1)=O)c1ccccc1[Cl] |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.9352 |
| logD: | 2.9348 |
| logSw: | -3.7639 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.208 |
| InChI Key: | QBEZAUDUMOZUOW-RCDICMHDSA-N |