5-[(3,4-dimethoxyphenyl)methylidene]-2-(4-methoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-[(3,4-dimethoxyphenyl)methylidene]-2-(4-methoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-[(3,4-dimethoxyphenyl)methylidene]-2-(4-methoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
Compound ID: | 5310-4881 |
Compound Name: | 5-[(3,4-dimethoxyphenyl)methylidene]-2-(4-methoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
Molecular Weight: | 395.44 |
Molecular Formula: | C20 H17 N3 O4 S |
Smiles: | COc1ccc(cc1)c1nc2n(C(/C(=C/c3ccc(c(c3)OC)OC)S2)=O)n1 |
Stereo: | ACHIRAL |
logP: | 3.6722 |
logD: | 3.6722 |
logSw: | -4.015 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 60 |
InChI Key: | MXNUUXXCAGAGCY-UHFFFAOYSA-N |