2-{5-[(4-ethoxy-3-methoxyphenyl)methylidene]-6-oxo-5,6-dihydro[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl}phenyl acetate
Chemical Structure Depiction of
2-{5-[(4-ethoxy-3-methoxyphenyl)methylidene]-6-oxo-5,6-dihydro[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl}phenyl acetate
2-{5-[(4-ethoxy-3-methoxyphenyl)methylidene]-6-oxo-5,6-dihydro[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl}phenyl acetate
Compound characteristics
| Compound ID: | 5629-0626 |
| Compound Name: | 2-{5-[(4-ethoxy-3-methoxyphenyl)methylidene]-6-oxo-5,6-dihydro[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl}phenyl acetate |
| Molecular Weight: | 437.47 |
| Molecular Formula: | C22 H19 N3 O5 S |
| Smiles: | [H]C(=C1/C(n2c(nc(c3ccccc3OC(C)=O)n2)S1)=O)\c1ccc(c(c1)OC)OCC |
| Stereo: | ACHIRAL |
| logP: | 3.3432 |
| logD: | 3.3432 |
| logSw: | -3.793 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 72.874 |
| InChI Key: | OHQPFVSNZFVSEC-UHFFFAOYSA-N |