3-acetyl-N-{2-[2-(4-fluorophenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl]ethyl}benzene-1-sulfonamide
Chemical Structure Depiction of
3-acetyl-N-{2-[2-(4-fluorophenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl]ethyl}benzene-1-sulfonamide
3-acetyl-N-{2-[2-(4-fluorophenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl]ethyl}benzene-1-sulfonamide
Compound characteristics
Compound ID: | G856-5145 |
Compound Name: | 3-acetyl-N-{2-[2-(4-fluorophenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl]ethyl}benzene-1-sulfonamide |
Molecular Weight: | 444.5 |
Molecular Formula: | C20 H17 F N4 O3 S2 |
Smiles: | CC(c1cccc(c1)S(NCCc1csc2nc(c3ccc(cc3)F)nn12)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.4162 |
logD: | 3.4161 |
logSw: | -3.9035 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 76.869 |
InChI Key: | JXONGDLQNCMXJJ-UHFFFAOYSA-N |