5-[(2-chloro-6-fluorophenyl)methylidene]-2-(4-fluorophenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-[(2-chloro-6-fluorophenyl)methylidene]-2-(4-fluorophenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-[(2-chloro-6-fluorophenyl)methylidene]-2-(4-fluorophenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
Compound ID: | 6187-2015 |
Compound Name: | 5-[(2-chloro-6-fluorophenyl)methylidene]-2-(4-fluorophenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
Molecular Weight: | 375.78 |
Molecular Formula: | C17 H8 Cl F2 N3 O S |
Smiles: | [H]C(=C1/C(n2c(nc(c3ccc(cc3)F)n2)S1)=O)\c1c(cccc1[Cl])F |
Stereo: | ACHIRAL |
logP: | 4.5546 |
logD: | 4.5546 |
logSw: | -4.6589 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 37.196 |
InChI Key: | YEEZILFFJXYQMD-UHFFFAOYSA-N |