1-{[6-(2-phenylethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}-1H-benzimidazole
Chemical Structure Depiction of
1-{[6-(2-phenylethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}-1H-benzimidazole
1-{[6-(2-phenylethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}-1H-benzimidazole
Compound characteristics
| Compound ID: | D064-0346 |
| Compound Name: | 1-{[6-(2-phenylethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}-1H-benzimidazole |
| Molecular Weight: | 360.44 |
| Molecular Formula: | C19 H16 N6 S |
| Smiles: | C(Cc1nn2c(Cn3cnc4ccccc34)nnc2s1)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.8769 |
| logD: | 1.7604 |
| logSw: | -3.0114 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 45.649 |
| InChI Key: | ZQMDFWSCQPSOHF-UHFFFAOYSA-N |