1-{[1-(5-fluoro-2-methylbenzene-1-sulfonyl)-4-hydroxypiperidin-4-yl]methyl}-N-methyl-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-{[1-(5-fluoro-2-methylbenzene-1-sulfonyl)-4-hydroxypiperidin-4-yl]methyl}-N-methyl-1H-1,2,3-triazole-4-carboxamide
1-{[1-(5-fluoro-2-methylbenzene-1-sulfonyl)-4-hydroxypiperidin-4-yl]methyl}-N-methyl-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB11-0631 |
| Compound Name: | 1-{[1-(5-fluoro-2-methylbenzene-1-sulfonyl)-4-hydroxypiperidin-4-yl]methyl}-N-methyl-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 411.45 |
| Molecular Formula: | C17 H22 F N5 O4 S |
| Smiles: | Cc1ccc(cc1S(N1CCC(CC1)(Cn1cc(C(NC)=O)nn1)O)(=O)=O)F |
| Stereo: | ACHIRAL |
| logP: | 0.4348 |
| logD: | 0.4348 |
| logSw: | -2.1776 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 98.871 |
| InChI Key: | JKBGLGYESBSXDM-UHFFFAOYSA-N |