4-({[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4H-1,2,4-triazol-4-yl]imino}methyl)-2-ethoxyphenol
Chemical Structure Depiction of
4-({[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4H-1,2,4-triazol-4-yl]imino}methyl)-2-ethoxyphenol
4-({[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4H-1,2,4-triazol-4-yl]imino}methyl)-2-ethoxyphenol
Compound characteristics
| Compound ID: | 8012-1369 |
| Compound Name: | 4-({[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4H-1,2,4-triazol-4-yl]imino}methyl)-2-ethoxyphenol |
| Molecular Weight: | 326.36 |
| Molecular Formula: | C16 H18 N6 O2 |
| Smiles: | CCOc1cc(/C=N/n2cnnc2n2c(C)cc(C)n2)ccc1O |
| Stereo: | ACHIRAL |
| logP: | 1.0855 |
| logD: | 1.0836 |
| logSw: | -1.6794 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.503 |
| InChI Key: | HEHBKGBFOOCIDA-UHFFFAOYSA-N |