5-(hydroxymethyl)-2-(4-methylphenyl)-N-[(4-methylphenyl)methyl]-2H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-(hydroxymethyl)-2-(4-methylphenyl)-N-[(4-methylphenyl)methyl]-2H-1,2,3-triazole-4-carboxamide
5-(hydroxymethyl)-2-(4-methylphenyl)-N-[(4-methylphenyl)methyl]-2H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | D217-0163 |
| Compound Name: | 5-(hydroxymethyl)-2-(4-methylphenyl)-N-[(4-methylphenyl)methyl]-2H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 336.39 |
| Molecular Formula: | C19 H20 N4 O2 |
| Smiles: | Cc1ccc(CNC(c2c(CO)nn(c3ccc(C)cc3)n2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.4971 |
| logD: | 2.497 |
| logSw: | -2.5904 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.136 |
| InChI Key: | BVRUNZLEUCBFKE-UHFFFAOYSA-N |