6-(1-benzofuran-2-yl)-3-(2-bromophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
6-(1-benzofuran-2-yl)-3-(2-bromophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-(1-benzofuran-2-yl)-3-(2-bromophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | D064-0019 |
| Compound Name: | 6-(1-benzofuran-2-yl)-3-(2-bromophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 397.25 |
| Molecular Formula: | C17 H9 Br N4 O S |
| Smiles: | c1ccc(c(c1)c1nnc2n1nc(c1cc3ccccc3o1)s2)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.5925 |
| logD: | 4.5925 |
| logSw: | -4.9039 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 42.014 |
| InChI Key: | XSYAXGNOBMOHSH-UHFFFAOYSA-N |