N-benzyl-2-{[5-(2-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-benzyl-2-{[5-(2-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-benzyl-2-{[5-(2-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
Compound ID: | V010-7604 |
Compound Name: | N-benzyl-2-{[5-(2-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
Molecular Weight: | 448.97 |
Molecular Formula: | C24 H21 Cl N4 O S |
Salt: | not_available |
Smiles: | Cc1ccc(cc1)n1c(c2ccccc2[Cl])nnc1SCC(NCc1ccccc1)=O |
Stereo: | ACHIRAL |
logP: | 5.1239 |
logD: | 5.1239 |
logSw: | -5.3473 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 49.184 |
InChI Key: | KCRJZUCBSAIRMM-UHFFFAOYSA-N |