1-[(1-benzyl-4-hydroxypiperidin-4-yl)methyl]-N-methyl-N-{2-oxo-2-[(propan-2-yl)amino]ethyl}-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-[(1-benzyl-4-hydroxypiperidin-4-yl)methyl]-N-methyl-N-{2-oxo-2-[(propan-2-yl)amino]ethyl}-1H-1,2,3-triazole-4-carboxamide
1-[(1-benzyl-4-hydroxypiperidin-4-yl)methyl]-N-methyl-N-{2-oxo-2-[(propan-2-yl)amino]ethyl}-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB11-0088 |
| Compound Name: | 1-[(1-benzyl-4-hydroxypiperidin-4-yl)methyl]-N-methyl-N-{2-oxo-2-[(propan-2-yl)amino]ethyl}-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 428.53 |
| Molecular Formula: | C22 H32 N6 O3 |
| Smiles: | CC(C)NC(CN(C)C(c1cn(CC2(CCN(CC2)Cc2ccccc2)O)nn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.3012 |
| logD: | -1.0096 |
| logSw: | -1.6646 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.925 |
| InChI Key: | YCSAHLKQMSUDCS-UHFFFAOYSA-N |