2-{[4-(4-chlorophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2,4,6-trimethoxyphenyl)methylidene]acetohydrazide
Chemical Structure Depiction of
2-{[4-(4-chlorophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2,4,6-trimethoxyphenyl)methylidene]acetohydrazide
2-{[4-(4-chlorophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2,4,6-trimethoxyphenyl)methylidene]acetohydrazide
Compound characteristics
| Compound ID: | 3254-2800 |
| Compound Name: | 2-{[4-(4-chlorophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2,4,6-trimethoxyphenyl)methylidene]acetohydrazide |
| Molecular Weight: | 538.02 |
| Molecular Formula: | C26 H24 Cl N5 O4 S |
| Smiles: | COc1cc(c(/C=N/NC(CSc2nnc(c3ccccc3)n2c2ccc(cc2)[Cl])=O)c(c1)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 5.5173 |
| logD: | 5.5173 |
| logSw: | -5.9545 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.891 |
| InChI Key: | JFBSSPBCIMMJJF-UHFFFAOYSA-N |