2-(4-ethoxyphenyl)-5-[(3,4,5-trimethoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
2-(4-ethoxyphenyl)-5-[(3,4,5-trimethoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
2-(4-ethoxyphenyl)-5-[(3,4,5-trimethoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
Compound ID: | 5310-4912 |
Compound Name: | 2-(4-ethoxyphenyl)-5-[(3,4,5-trimethoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
Molecular Weight: | 439.49 |
Molecular Formula: | C22 H21 N3 O5 S |
Smiles: | CCOc1ccc(cc1)c1nc2n(C(/C(=C/c3cc(c(c(c3)OC)OC)OC)S2)=O)n1 |
Stereo: | ACHIRAL |
logP: | 4.2093 |
logD: | 4.2093 |
logSw: | -4.3089 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 67.298 |
InChI Key: | ZYJOWTLFRXQDCW-UHFFFAOYSA-N |