3-(2-bromophenyl)-6-(2-phenylethenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-(2-bromophenyl)-6-(2-phenylethenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-(2-bromophenyl)-6-(2-phenylethenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D064-0013 |
| Compound Name: | 3-(2-bromophenyl)-6-(2-phenylethenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 383.27 |
| Molecular Formula: | C17 H11 Br N4 S |
| Smiles: | C(=C/c1nn2c(c3ccccc3[Br])nnc2s1)\c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.0887 |
| logD: | 4.0887 |
| logSw: | -4.6261 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 34.217 |
| InChI Key: | RJNBWOCZLQCUHV-UHFFFAOYSA-N |