methyl [2-(2-chlorophenyl)hydrazinylidene]({5-[hydroxy(phenyl)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetate
Chemical Structure Depiction of
methyl [2-(2-chlorophenyl)hydrazinylidene]({5-[hydroxy(phenyl)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetate
methyl [2-(2-chlorophenyl)hydrazinylidene]({5-[hydroxy(phenyl)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetate
Compound characteristics
Compound ID: | 8014-4331 |
Compound Name: | methyl [2-(2-chlorophenyl)hydrazinylidene]({5-[hydroxy(phenyl)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetate |
Molecular Weight: | 493.97 |
Molecular Formula: | C24 H20 Cl N5 O3 S |
Smiles: | COC(\C(=N/Nc1ccccc1[Cl])Sc1nnc(C(c2ccccc2)O)n1c1ccccc1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.8484 |
logD: | 4.8483 |
logSw: | -4.6544 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 82.294 |
InChI Key: | CPVQHCRYMVLZRE-HXUWFJFHSA-N |