2-(2,4-dichlorophenoxy)-N-{[4-(2,6-diethylphenyl)-5-(propylsulfanyl)-4H-1,2,4-triazol-3-yl]methyl}acetamide
Chemical Structure Depiction of
2-(2,4-dichlorophenoxy)-N-{[4-(2,6-diethylphenyl)-5-(propylsulfanyl)-4H-1,2,4-triazol-3-yl]methyl}acetamide
2-(2,4-dichlorophenoxy)-N-{[4-(2,6-diethylphenyl)-5-(propylsulfanyl)-4H-1,2,4-triazol-3-yl]methyl}acetamide
Compound characteristics
Compound ID: | K400-08561 |
Compound Name: | 2-(2,4-dichlorophenoxy)-N-{[4-(2,6-diethylphenyl)-5-(propylsulfanyl)-4H-1,2,4-triazol-3-yl]methyl}acetamide |
Molecular Weight: | 507.48 |
Molecular Formula: | C24 H28 Cl2 N4 O2 S |
Smiles: | CCCSc1nnc(CNC(COc2ccc(cc2[Cl])[Cl])=O)n1c1c(CC)cccc1CC |
Stereo: | ACHIRAL |
logP: | 6.1439 |
logD: | 6.1439 |
logSw: | -6.161 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 57.416 |
InChI Key: | RIHWSGLHYBNBCK-UHFFFAOYSA-N |