2-{[(3,5-dimethyl-4H-1,2,4-triazol-4-yl)imino]methyl}-6-ethoxyphenol
Chemical Structure Depiction of
2-{[(3,5-dimethyl-4H-1,2,4-triazol-4-yl)imino]methyl}-6-ethoxyphenol
2-{[(3,5-dimethyl-4H-1,2,4-triazol-4-yl)imino]methyl}-6-ethoxyphenol
Compound characteristics
| Compound ID: | 3253-0785 |
| Compound Name: | 2-{[(3,5-dimethyl-4H-1,2,4-triazol-4-yl)imino]methyl}-6-ethoxyphenol |
| Molecular Weight: | 260.29 |
| Molecular Formula: | C13 H16 N4 O2 |
| Smiles: | CCOc1cccc(/C=N/n2c(C)nnc2C)c1O |
| Stereo: | ACHIRAL |
| logP: | 1.1352 |
| logD: | 1.058 |
| logSw: | -1.7463 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.538 |
| InChI Key: | ISQUNRNGRXTHDG-UHFFFAOYSA-N |