rel-(2R,3R)-N-{2-[benzyl(ethyl)amino]ethyl}-1-(2-methylpropyl)-6-oxo-2-(pyridin-3-yl)piperidine-3-carboxamide
Chemical Structure Depiction of
rel-(2R,3R)-N-{2-[benzyl(ethyl)amino]ethyl}-1-(2-methylpropyl)-6-oxo-2-(pyridin-3-yl)piperidine-3-carboxamide
rel-(2R,3R)-N-{2-[benzyl(ethyl)amino]ethyl}-1-(2-methylpropyl)-6-oxo-2-(pyridin-3-yl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | SB13-0300 |
| Compound Name: | rel-(2R,3R)-N-{2-[benzyl(ethyl)amino]ethyl}-1-(2-methylpropyl)-6-oxo-2-(pyridin-3-yl)piperidine-3-carboxamide |
| Molecular Weight: | 436.6 |
| Molecular Formula: | C26 H36 N4 O2 |
| Smiles: | CCN(CCNC([C@@H]1CCC(N(CC(C)C)[C@H]1c1cccnc1)=O)=O)Cc1ccccc1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.9076 |
| logD: | 2.0567 |
| logSw: | -3.3373 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.931 |
| InChI Key: | OBQSLTKBNIMTLV-ILBGXUMGSA-N |