2-{[4-(4-chlorophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-dimethylphenyl)acetamide
Chemical Structure Depiction of
2-{[4-(4-chlorophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-dimethylphenyl)acetamide
2-{[4-(4-chlorophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-dimethylphenyl)acetamide
Compound characteristics
Compound ID: | F019-0293 |
Compound Name: | 2-{[4-(4-chlorophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-dimethylphenyl)acetamide |
Molecular Weight: | 448.97 |
Molecular Formula: | C24 H21 Cl N4 O S |
Smiles: | Cc1ccc(c(C)c1)NC(CSc1nnc(c2ccccc2)n1c1ccc(cc1)[Cl])=O |
Stereo: | ACHIRAL |
logP: | 5.7598 |
logD: | 5.7598 |
logSw: | -5.9638 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 47.164 |
InChI Key: | FIHOBVNBHGCXRS-UHFFFAOYSA-N |