5-({[5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(2-methylphenyl)-1,2,4-oxadiazole
Chemical Structure Depiction of
5-({[5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(2-methylphenyl)-1,2,4-oxadiazole
5-({[5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(2-methylphenyl)-1,2,4-oxadiazole
Compound characteristics
Compound ID: | D141-0008 |
Compound Name: | 5-({[5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(2-methylphenyl)-1,2,4-oxadiazole |
Molecular Weight: | 411.91 |
Molecular Formula: | C20 H18 Cl N5 O S |
Smiles: | CCn1c(c2ccc(cc2)[Cl])nnc1SCc1nc(c2ccccc2C)no1 |
Stereo: | ACHIRAL |
logP: | 5.5908 |
logD: | 5.5906 |
logSw: | -6.0325 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 55.308 |
InChI Key: | ZHQCYTZKLSOLDP-UHFFFAOYSA-N |