1-{[6-(2-bromophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}-1H-benzimidazole
Chemical Structure Depiction of
1-{[6-(2-bromophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}-1H-benzimidazole
1-{[6-(2-bromophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}-1H-benzimidazole
Compound characteristics
| Compound ID: | D064-0329 |
| Compound Name: | 1-{[6-(2-bromophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}-1H-benzimidazole |
| Molecular Weight: | 411.28 |
| Molecular Formula: | C17 H11 Br N6 S |
| Smiles: | C(c1nnc2n1nc(c1ccccc1[Br])s2)n1cnc2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 2.717 |
| logD: | 1.6005 |
| logSw: | -3.2727 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 45.154 |
| InChI Key: | WEZUYYQPXWQPRX-UHFFFAOYSA-N |