2-ethoxy-4-({2-[2-(4-fluorophenyl)ethenyl]-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene}methyl)phenyl acetate
Chemical Structure Depiction of
2-ethoxy-4-({2-[2-(4-fluorophenyl)ethenyl]-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene}methyl)phenyl acetate
2-ethoxy-4-({2-[2-(4-fluorophenyl)ethenyl]-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene}methyl)phenyl acetate
Compound characteristics
| Compound ID: | Y070-4655 |
| Compound Name: | 2-ethoxy-4-({2-[2-(4-fluorophenyl)ethenyl]-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene}methyl)phenyl acetate |
| Molecular Weight: | 451.48 |
| Molecular Formula: | C23 H18 F N3 O4 S |
| Smiles: | CCOc1cc(/C=C2/C(n3c(nc(/C=C/c4ccc(cc4)F)n3)S2)=O)ccc1OC(C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8938 |
| logD: | 3.8938 |
| logSw: | -4.0589 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.234 |
| InChI Key: | NKUSELGLOMEUDK-UHFFFAOYSA-N |