5-[(3-ethoxy-4-propoxyphenyl)methylidene]-2-(4-propoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-[(3-ethoxy-4-propoxyphenyl)methylidene]-2-(4-propoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-[(3-ethoxy-4-propoxyphenyl)methylidene]-2-(4-propoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 6187-0885 |
| Compound Name: | 5-[(3-ethoxy-4-propoxyphenyl)methylidene]-2-(4-propoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 465.57 |
| Molecular Formula: | C25 H27 N3 O4 S |
| Smiles: | [H]C(=C1/C(n2c(nc(c3ccc(cc3)OCCC)n2)S1)=O)\c1ccc(c(c1)OCC)OCCC |
| Stereo: | ACHIRAL |
| logP: | 5.8169 |
| logD: | 5.8169 |
| logSw: | -5.555 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.328 |
| InChI Key: | BNDLJRPQRIPCAW-UHFFFAOYSA-N |