6-[5-(2,5-dichlorophenyl)furan-2-yl]-3-(furan-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
6-[5-(2,5-dichlorophenyl)furan-2-yl]-3-(furan-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-[5-(2,5-dichlorophenyl)furan-2-yl]-3-(furan-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
Compound ID: | D731-0578 |
Compound Name: | 6-[5-(2,5-dichlorophenyl)furan-2-yl]-3-(furan-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
Molecular Weight: | 403.24 |
Molecular Formula: | C17 H8 Cl2 N4 O2 S |
Smiles: | c1cc(c2nnc3n2nc(c2ccc(c4cc(ccc4[Cl])[Cl])o2)s3)oc1 |
Stereo: | ACHIRAL |
logP: | 4.8911 |
logD: | 4.8911 |
logSw: | -5.1112 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 50.699 |
InChI Key: | DGRFJBBUGVTLLS-UHFFFAOYSA-N |