1-{[1-(5-chloro-2-fluorobenzoyl)-4-hydroxypiperidin-4-yl]methyl}-N-methyl-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-{[1-(5-chloro-2-fluorobenzoyl)-4-hydroxypiperidin-4-yl]methyl}-N-methyl-1H-1,2,3-triazole-4-carboxamide
1-{[1-(5-chloro-2-fluorobenzoyl)-4-hydroxypiperidin-4-yl]methyl}-N-methyl-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB11-0605 |
| Compound Name: | 1-{[1-(5-chloro-2-fluorobenzoyl)-4-hydroxypiperidin-4-yl]methyl}-N-methyl-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 395.82 |
| Molecular Formula: | C17 H19 Cl F N5 O3 |
| Smiles: | CNC(c1cn(CC2(CCN(CC2)C(c2cc(ccc2F)[Cl])=O)O)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.4309 |
| logD: | 0.4309 |
| logSw: | -2.5979 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.808 |
| InChI Key: | PETGJSMVEHEMBG-UHFFFAOYSA-N |