2-({[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)-N-phenylhydrazine-1-carbothioamide
Chemical Structure Depiction of
2-({[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)-N-phenylhydrazine-1-carbothioamide
2-({[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)-N-phenylhydrazine-1-carbothioamide
Compound characteristics
Compound ID: | 3254-1583 |
Compound Name: | 2-({[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)-N-phenylhydrazine-1-carbothioamide |
Molecular Weight: | 516.69 |
Molecular Formula: | C27 H28 N6 O S2 |
Smiles: | CC(C)(C)c1ccc(cc1)c1nnc(n1c1ccccc1)SCC(NNC(Nc1ccccc1)=S)=O |
Stereo: | ACHIRAL |
logP: | 5.74 |
logD: | 5.7365 |
logSw: | -5.5193 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 71.698 |
InChI Key: | ZBSOLHYVUUSNPK-UHFFFAOYSA-N |