2-{[(3,5-dimethyl-4H-1,2,4-triazol-4-yl)imino]methyl}-4,6-diiodophenol
Chemical Structure Depiction of
2-{[(3,5-dimethyl-4H-1,2,4-triazol-4-yl)imino]methyl}-4,6-diiodophenol
2-{[(3,5-dimethyl-4H-1,2,4-triazol-4-yl)imino]methyl}-4,6-diiodophenol
Compound characteristics
| Compound ID: | 3254-0279 |
| Compound Name: | 2-{[(3,5-dimethyl-4H-1,2,4-triazol-4-yl)imino]methyl}-4,6-diiodophenol |
| Molecular Weight: | 468.03 |
| Molecular Formula: | C11 H10 I2 N4 O |
| Smiles: | Cc1nnc(C)n1/N=C/c1cc(cc(c1O)I)I |
| Stereo: | ACHIRAL |
| logP: | 2.8267 |
| logD: | 1.9179 |
| logSw: | -2.6928 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.328 |
| InChI Key: | GZIQOBBQNZKEHH-UHFFFAOYSA-N |