2-(thiophen-2-yl)-5-[(3,4,5-trimethoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
2-(thiophen-2-yl)-5-[(3,4,5-trimethoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
2-(thiophen-2-yl)-5-[(3,4,5-trimethoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
Compound ID: | 5629-0691 |
Compound Name: | 2-(thiophen-2-yl)-5-[(3,4,5-trimethoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
Molecular Weight: | 401.46 |
Molecular Formula: | C18 H15 N3 O4 S2 |
Smiles: | [H]C(=C1/C(n2c(nc(c3cccs3)n2)S1)=O)\c1cc(c(c(c1)OC)OC)OC |
Stereo: | ACHIRAL |
logP: | 3.5607 |
logD: | 3.5607 |
logSw: | -3.7436 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 61.192 |
InChI Key: | FKIKSGNNCCTFHC-UHFFFAOYSA-N |