4-{[2-(2-chloro-4,5-difluorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}-2-ethoxy-6-iodophenyl acetate
Chemical Structure Depiction of
4-{[2-(2-chloro-4,5-difluorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}-2-ethoxy-6-iodophenyl acetate
4-{[2-(2-chloro-4,5-difluorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}-2-ethoxy-6-iodophenyl acetate
Compound characteristics
| Compound ID: | 2062-1299 |
| Compound Name: | 4-{[2-(2-chloro-4,5-difluorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}-2-ethoxy-6-iodophenyl acetate |
| Molecular Weight: | 547.68 |
| Molecular Formula: | C20 H13 Cl F2 I N O5 |
| Smiles: | CCOc1cc(/C=C2/C(=O)OC(c3cc(c(cc3[Cl])F)F)=N2)cc(c1OC(C)=O)I |
| Stereo: | ACHIRAL |
| logP: | 4.7513 |
| logD: | 4.7513 |
| logSw: | -4.9874 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.51 |
| InChI Key: | AUQZHKJOIAIYDU-UHFFFAOYSA-N |