rel-(2R,3R)-2-(4-fluorophenyl)-1-(2-methoxyethyl)-6-oxo-N-[3-(1H-pyrazol-1-yl)propyl]piperidine-3-carboxamide
Chemical Structure Depiction of
rel-(2R,3R)-2-(4-fluorophenyl)-1-(2-methoxyethyl)-6-oxo-N-[3-(1H-pyrazol-1-yl)propyl]piperidine-3-carboxamide
rel-(2R,3R)-2-(4-fluorophenyl)-1-(2-methoxyethyl)-6-oxo-N-[3-(1H-pyrazol-1-yl)propyl]piperidine-3-carboxamide
Compound characteristics
| Compound ID: | SB13-0396 |
| Compound Name: | rel-(2R,3R)-2-(4-fluorophenyl)-1-(2-methoxyethyl)-6-oxo-N-[3-(1H-pyrazol-1-yl)propyl]piperidine-3-carboxamide |
| Molecular Weight: | 402.47 |
| Molecular Formula: | C21 H27 F N4 O3 |
| Smiles: | COCCN1C(CC[C@@H](C(NCCCn2cccn2)=O)[C@@H]1c1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.9485 |
| logD: | 0.9485 |
| logSw: | -2.4027 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.821 |
| InChI Key: | FLHSEUXLWKPTQL-AZUAARDMSA-N |