1-[(1-benzyl-4-hydroxypiperidin-4-yl)methyl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-[(1-benzyl-4-hydroxypiperidin-4-yl)methyl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-1H-1,2,3-triazole-4-carboxamide
1-[(1-benzyl-4-hydroxypiperidin-4-yl)methyl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB11-0081 |
| Compound Name: | 1-[(1-benzyl-4-hydroxypiperidin-4-yl)methyl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 437.54 |
| Molecular Formula: | C23 H31 N7 O2 |
| Smiles: | Cc1c(CNC(c2cn(CC3(CCN(CC3)Cc3ccccc3)O)nn2)=O)c(C)n(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 0.7281 |
| logD: | -0.5827 |
| logSw: | -1.6136 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.31 |
| InChI Key: | NDIULZXPYGTFDD-UHFFFAOYSA-N |