6-benzyl-3-(4-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
6-benzyl-3-(4-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-benzyl-3-(4-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
Compound ID: | D064-0029 |
Compound Name: | 6-benzyl-3-(4-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
Molecular Weight: | 306.39 |
Molecular Formula: | C17 H14 N4 S |
Smiles: | Cc1ccc(cc1)c1nnc2n1nc(Cc1ccccc1)s2 |
Stereo: | ACHIRAL |
logP: | 4.0565 |
logD: | 4.0565 |
logSw: | -4.1622 |
Hydrogen bond acceptors count: | 3 |
Polar surface area: | 34.217 |
InChI Key: | PKURUMZGHRJOJT-UHFFFAOYSA-N |