5-[(3-ethoxy-4-propoxyphenyl)methylidene]-2-(thiophen-2-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-[(3-ethoxy-4-propoxyphenyl)methylidene]-2-(thiophen-2-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-[(3-ethoxy-4-propoxyphenyl)methylidene]-2-(thiophen-2-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
Compound ID: | 5606-4303 |
Compound Name: | 5-[(3-ethoxy-4-propoxyphenyl)methylidene]-2-(thiophen-2-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
Molecular Weight: | 413.52 |
Molecular Formula: | C20 H19 N3 O3 S2 |
Smiles: | CCCOc1ccc(/C=C2/C(n3c(nc(c4cccs4)n3)S2)=O)cc1OCC |
Stereo: | ACHIRAL |
logP: | 4.578 |
logD: | 4.578 |
logSw: | -4.4559 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 52.929 |
InChI Key: | NHDSURKKBJGQMB-UHFFFAOYSA-N |