5-(hydroxymethyl)-N-[(3-methoxyphenyl)methyl]-2-phenyl-2H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-(hydroxymethyl)-N-[(3-methoxyphenyl)methyl]-2-phenyl-2H-1,2,3-triazole-4-carboxamide
5-(hydroxymethyl)-N-[(3-methoxyphenyl)methyl]-2-phenyl-2H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | D217-0045 |
| Compound Name: | 5-(hydroxymethyl)-N-[(3-methoxyphenyl)methyl]-2-phenyl-2H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 338.36 |
| Molecular Formula: | C18 H18 N4 O3 |
| Smiles: | COc1cccc(CNC(c2c(CO)nn(c3ccccc3)n2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 1.626 |
| logD: | 1.626 |
| logSw: | -2.0337 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.68 |
| InChI Key: | WCYJSGVUZCWMJF-UHFFFAOYSA-N |