2-{[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2-hydroxy-3-methoxyphenyl)methylidene]acetohydrazide
Chemical Structure Depiction of
2-{[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2-hydroxy-3-methoxyphenyl)methylidene]acetohydrazide
2-{[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2-hydroxy-3-methoxyphenyl)methylidene]acetohydrazide
Compound characteristics
Compound ID: | 2357-3651 |
Compound Name: | 2-{[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2-hydroxy-3-methoxyphenyl)methylidene]acetohydrazide |
Molecular Weight: | 493.97 |
Molecular Formula: | C24 H20 Cl N5 O3 S |
Smiles: | COc1cccc(/C=N/NC(CSc2nnc(c3ccc(cc3)[Cl])n2c2ccccc2)=O)c1O |
Stereo: | ACHIRAL |
logP: | 5.1072 |
logD: | 5.1044 |
logSw: | -5.2767 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 83.196 |
InChI Key: | CMTAHJUDUBYEPW-UHFFFAOYSA-N |