2-{[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2-hydroxy-3,5-diiodophenyl)methylidene]acetohydrazide
Chemical Structure Depiction of
2-{[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2-hydroxy-3,5-diiodophenyl)methylidene]acetohydrazide
2-{[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2-hydroxy-3,5-diiodophenyl)methylidene]acetohydrazide
Compound characteristics
| Compound ID: | 3254-2006 |
| Compound Name: | 2-{[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2-hydroxy-3,5-diiodophenyl)methylidene]acetohydrazide |
| Molecular Weight: | 663.27 |
| Molecular Formula: | C20 H19 I2 N5 O3 S |
| Smiles: | CCn1c(c2ccc(cc2)OC)nnc1SCC(N/N=C/c1cc(cc(c1O)I)I)=O |
| Stereo: | ACHIRAL |
| logP: | 5.782 |
| logD: | 5.7299 |
| logSw: | -5.2988 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.362 |
| InChI Key: | KEHAUNGCXXEQQS-UHFFFAOYSA-N |