N-(2-ethoxyphenyl)-2-{[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2-ethoxyphenyl)-2-{[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-(2-ethoxyphenyl)-2-{[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
Compound ID: | 8014-5917 |
Compound Name: | N-(2-ethoxyphenyl)-2-{[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
Molecular Weight: | 444.55 |
Molecular Formula: | C25 H24 N4 O2 S |
Smiles: | CCOc1ccccc1NC(CSc1nnc(c2ccc(C)cc2)n1c1ccccc1)=O |
Stereo: | ACHIRAL |
logP: | 5.264 |
logD: | 5.264 |
logSw: | -5.0817 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 54.374 |
InChI Key: | GQBIKBMOQOXEDD-UHFFFAOYSA-N |