N-(2,4-dimethylphenyl)-2-{[4-(4-fluorophenyl)-5-(1H-indol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2,4-dimethylphenyl)-2-{[4-(4-fluorophenyl)-5-(1H-indol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-(2,4-dimethylphenyl)-2-{[4-(4-fluorophenyl)-5-(1H-indol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
Compound ID: | G878-0198 |
Compound Name: | N-(2,4-dimethylphenyl)-2-{[4-(4-fluorophenyl)-5-(1H-indol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
Molecular Weight: | 471.56 |
Molecular Formula: | C26 H22 F N5 O S |
Smiles: | Cc1ccc(c(C)c1)NC(CSc1nnc(c2c[nH]c3ccccc23)n1c1ccc(cc1)F)=O |
Stereo: | ACHIRAL |
logP: | 5.4296 |
logD: | 5.4296 |
logSw: | -5.5261 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 57.035 |
InChI Key: | JONJUUIATPVXIL-UHFFFAOYSA-N |