3-(furan-2-yl)-6-[5-(4-nitrophenyl)furan-2-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-(furan-2-yl)-6-[5-(4-nitrophenyl)furan-2-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-(furan-2-yl)-6-[5-(4-nitrophenyl)furan-2-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | 6682-0022 |
| Compound Name: | 3-(furan-2-yl)-6-[5-(4-nitrophenyl)furan-2-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 379.35 |
| Molecular Formula: | C17 H9 N5 O4 S |
| Smiles: | c1cc(c2nnc3n2nc(c2ccc(c4ccc(cc4)[N+]([O-])=O)o2)s3)oc1 |
| Stereo: | ACHIRAL |
| logP: | 3.7062 |
| logD: | 3.7062 |
| logSw: | -4.1789 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 84.081 |
| InChI Key: | ZDMATLHEEYCKBD-UHFFFAOYSA-N |