6-bromo-4-[3-(furan-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-phenylquinoline
Chemical Structure Depiction of
6-bromo-4-[3-(furan-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-phenylquinoline
6-bromo-4-[3-(furan-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-phenylquinoline
Compound characteristics
Compound ID: | 7101-0253 |
Compound Name: | 6-bromo-4-[3-(furan-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-phenylquinoline |
Molecular Weight: | 474.34 |
Molecular Formula: | C22 H12 Br N5 O S |
Smiles: | c1ccc(cc1)c1cc(c2cc(ccc2n1)[Br])c1nn2c(c3ccco3)nnc2s1 |
Stereo: | ACHIRAL |
logP: | 5.902 |
logD: | 5.9001 |
logSw: | -6.2178 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 50.359 |
InChI Key: | GDHJUZGGCKUVEZ-UHFFFAOYSA-N |