1-{[1-(2-chlorobenzene-1-sulfonyl)-4-hydroxypiperidin-4-yl]methyl}-N-methyl-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-{[1-(2-chlorobenzene-1-sulfonyl)-4-hydroxypiperidin-4-yl]methyl}-N-methyl-1H-1,2,3-triazole-4-carboxamide
1-{[1-(2-chlorobenzene-1-sulfonyl)-4-hydroxypiperidin-4-yl]methyl}-N-methyl-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB11-0621 |
| Compound Name: | 1-{[1-(2-chlorobenzene-1-sulfonyl)-4-hydroxypiperidin-4-yl]methyl}-N-methyl-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 413.88 |
| Molecular Formula: | C16 H20 Cl N5 O4 S |
| Smiles: | CNC(c1cn(CC2(CCN(CC2)S(c2ccccc2[Cl])(=O)=O)O)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.1964 |
| logD: | 0.1964 |
| logSw: | -2.4513 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 98.871 |
| InChI Key: | NMULFIYEBNJFGX-UHFFFAOYSA-N |