rel-(2R,3R)-2-methyl-N-[(1-methyl-1H-benzimidazol-2-yl)methyl]-1-(2-methylpropyl)-6-oxopiperidine-3-carboxamide
Chemical Structure Depiction of
rel-(2R,3R)-2-methyl-N-[(1-methyl-1H-benzimidazol-2-yl)methyl]-1-(2-methylpropyl)-6-oxopiperidine-3-carboxamide
rel-(2R,3R)-2-methyl-N-[(1-methyl-1H-benzimidazol-2-yl)methyl]-1-(2-methylpropyl)-6-oxopiperidine-3-carboxamide
Compound characteristics
| Compound ID: | SA17-0160 |
| Compound Name: | rel-(2R,3R)-2-methyl-N-[(1-methyl-1H-benzimidazol-2-yl)methyl]-1-(2-methylpropyl)-6-oxopiperidine-3-carboxamide |
| Molecular Weight: | 356.47 |
| Molecular Formula: | C20 H28 N4 O2 |
| Smiles: | CC(C)CN1C(CC[C@@H](C(NCc2nc3ccccc3n2C)=O)[C@H]1C)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.3805 |
| logD: | 2.3787 |
| logSw: | -3.0792 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.734 |
| InChI Key: | VHUXYHQDGKVATP-LSDHHAIUSA-N |