1-[(1-benzyl-4-hydroxypiperidin-4-yl)methyl]-N-(3-methylbutyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-[(1-benzyl-4-hydroxypiperidin-4-yl)methyl]-N-(3-methylbutyl)-1H-1,2,3-triazole-4-carboxamide
1-[(1-benzyl-4-hydroxypiperidin-4-yl)methyl]-N-(3-methylbutyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB11-0053 |
| Compound Name: | 1-[(1-benzyl-4-hydroxypiperidin-4-yl)methyl]-N-(3-methylbutyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 385.51 |
| Molecular Formula: | C21 H31 N5 O2 |
| Smiles: | CC(C)CCNC(c1cn(CC2(CCN(CC2)Cc2ccccc2)O)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0079 |
| logD: | 0.6972 |
| logSw: | -2.2533 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.584 |
| InChI Key: | SJHUHQKEEDPKEJ-UHFFFAOYSA-N |