4-{[(3,5-dimethyl-4H-1,2,4-triazol-4-yl)imino]methyl}-2-methoxyphenyl acetate
Chemical Structure Depiction of
4-{[(3,5-dimethyl-4H-1,2,4-triazol-4-yl)imino]methyl}-2-methoxyphenyl acetate
4-{[(3,5-dimethyl-4H-1,2,4-triazol-4-yl)imino]methyl}-2-methoxyphenyl acetate
Compound characteristics
| Compound ID: | 3254-0261 |
| Compound Name: | 4-{[(3,5-dimethyl-4H-1,2,4-triazol-4-yl)imino]methyl}-2-methoxyphenyl acetate |
| Molecular Weight: | 288.3 |
| Molecular Formula: | C14 H16 N4 O3 |
| Smiles: | CC(=O)Oc1ccc(/C=N/n2c(C)nnc2C)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 0.3671 |
| logD: | 0.3647 |
| logSw: | -1.7938 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.317 |
| InChI Key: | JKXZPGHHCHPMQF-UHFFFAOYSA-N |