rel-(2R,3S)-N-[(1H-benzimidazol-2-yl)methyl]-1-(2-methoxyethyl)-2-(4-methylphenyl)-6-oxopiperidine-3-carboxamide
Chemical Structure Depiction of
rel-(2R,3S)-N-[(1H-benzimidazol-2-yl)methyl]-1-(2-methoxyethyl)-2-(4-methylphenyl)-6-oxopiperidine-3-carboxamide
rel-(2R,3S)-N-[(1H-benzimidazol-2-yl)methyl]-1-(2-methoxyethyl)-2-(4-methylphenyl)-6-oxopiperidine-3-carboxamide
Compound characteristics
| Compound ID: | SA17-0657 |
| Compound Name: | rel-(2R,3S)-N-[(1H-benzimidazol-2-yl)methyl]-1-(2-methoxyethyl)-2-(4-methylphenyl)-6-oxopiperidine-3-carboxamide |
| Molecular Weight: | 420.51 |
| Molecular Formula: | C24 H28 N4 O3 |
| Smiles: | Cc1ccc(cc1)[C@@H]1[C@@H](CCC(N1CCOC)=O)C(NCc1nc2ccccc2[nH]1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.7243 |
| logD: | 2.7239 |
| logSw: | -3.4776 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.488 |
| InChI Key: | NAQIFNWBXBLNMC-WZONZLPQSA-N |