1-[(4-hydroxypiperidin-4-yl)methyl]-N-{2-[2-(pyridin-2-yl)ethyl]phenyl}-1H-1,2,3-triazole-4-carboxamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-[(4-hydroxypiperidin-4-yl)methyl]-N-{2-[2-(pyridin-2-yl)ethyl]phenyl}-1H-1,2,3-triazole-4-carboxamide--hydrogen chloride (1/1)
1-[(4-hydroxypiperidin-4-yl)methyl]-N-{2-[2-(pyridin-2-yl)ethyl]phenyl}-1H-1,2,3-triazole-4-carboxamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | SB11-0330 |
| Compound Name: | 1-[(4-hydroxypiperidin-4-yl)methyl]-N-{2-[2-(pyridin-2-yl)ethyl]phenyl}-1H-1,2,3-triazole-4-carboxamide--hydrogen chloride (1/1) |
| Molecular Weight: | 442.95 |
| Molecular Formula: | C22 H26 N6 O2 |
| Salt: | HCl |
| Smiles: | C(Cc1ccccn1)c1ccccc1NC(c1cn(CC2(CCNCC2)O)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7414 |
| logD: | -2.4093 |
| logSw: | -1.7482 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 86.142 |
| InChI Key: | YYOJHAOHFRSYQB-UHFFFAOYSA-N |