N-(3-chloro-4-fluorophenyl)-4-hydroxy-4-{[4-(methylcarbamoyl)-1H-1,2,3-triazol-1-yl]methyl}piperidine-1-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-4-hydroxy-4-{[4-(methylcarbamoyl)-1H-1,2,3-triazol-1-yl]methyl}piperidine-1-carboxamide
N-(3-chloro-4-fluorophenyl)-4-hydroxy-4-{[4-(methylcarbamoyl)-1H-1,2,3-triazol-1-yl]methyl}piperidine-1-carboxamide
Compound characteristics
| Compound ID: | SB11-0724 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-4-hydroxy-4-{[4-(methylcarbamoyl)-1H-1,2,3-triazol-1-yl]methyl}piperidine-1-carboxamide |
| Molecular Weight: | 410.83 |
| Molecular Formula: | C17 H20 Cl F N6 O3 |
| Smiles: | CNC(c1cn(CC2(CCN(CC2)C(Nc2ccc(c(c2)[Cl])F)=O)O)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5913 |
| logD: | 0.5908 |
| logSw: | -2.6579 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 92.629 |
| InChI Key: | KBOXYCWQALNENW-UHFFFAOYSA-N |