6-(3-ethoxyphenyl)-3-[(phenylsulfanyl)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
6-(3-ethoxyphenyl)-3-[(phenylsulfanyl)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-(3-ethoxyphenyl)-3-[(phenylsulfanyl)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
Compound ID: | D727-0197 |
Compound Name: | 6-(3-ethoxyphenyl)-3-[(phenylsulfanyl)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
Molecular Weight: | 368.48 |
Molecular Formula: | C18 H16 N4 O S2 |
Smiles: | CCOc1cccc(c1)c1nn2c(CSc3ccccc3)nnc2s1 |
Stereo: | ACHIRAL |
logP: | 4.0342 |
logD: | 4.0342 |
logSw: | -4.036 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 41.821 |
InChI Key: | JJPXXWKPKOHUIZ-UHFFFAOYSA-N |