1-{[6-(2-phenylethenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}-1H-benzimidazole
Chemical Structure Depiction of
1-{[6-(2-phenylethenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}-1H-benzimidazole
1-{[6-(2-phenylethenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}-1H-benzimidazole
Compound characteristics
Compound ID: | D064-0357 |
Compound Name: | 1-{[6-(2-phenylethenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}-1H-benzimidazole |
Molecular Weight: | 358.42 |
Molecular Formula: | C19 H14 N6 S |
Smiles: | C(c1nnc2n1nc(/C=C/c1ccccc1)s2)n1cnc2ccccc12 |
Stereo: | ACHIRAL |
logP: | 2.721 |
logD: | 1.6044 |
logSw: | -2.7321 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 45.649 |
InChI Key: | ITBWBQGHNDUXQD-UHFFFAOYSA-N |