N-(1-hydroxybutan-2-yl)-5-(hydroxymethyl)-2-(4-methylphenyl)-2H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-(1-hydroxybutan-2-yl)-5-(hydroxymethyl)-2-(4-methylphenyl)-2H-1,2,3-triazole-4-carboxamide
N-(1-hydroxybutan-2-yl)-5-(hydroxymethyl)-2-(4-methylphenyl)-2H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | D217-0197 |
| Compound Name: | N-(1-hydroxybutan-2-yl)-5-(hydroxymethyl)-2-(4-methylphenyl)-2H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 304.35 |
| Molecular Formula: | C15 H20 N4 O3 |
| Smiles: | CCC(CO)NC(c1c(CO)nn(c2ccc(C)cc2)n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.9681 |
| logD: | 0.9681 |
| logSw: | -1.8495 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.431 |
| InChI Key: | DGRRCFJIRWPQAV-NSHDSACASA-N |