3-({2-[2-(2,3-dichlorophenyl)ethenyl]-5-oxo-1,3-oxazol-4(5H)-ylidene}methyl)phenyl acetate
Chemical Structure Depiction of
3-({2-[2-(2,3-dichlorophenyl)ethenyl]-5-oxo-1,3-oxazol-4(5H)-ylidene}methyl)phenyl acetate
3-({2-[2-(2,3-dichlorophenyl)ethenyl]-5-oxo-1,3-oxazol-4(5H)-ylidene}methyl)phenyl acetate
Compound characteristics
Compound ID: | K088-1721 |
Compound Name: | 3-({2-[2-(2,3-dichlorophenyl)ethenyl]-5-oxo-1,3-oxazol-4(5H)-ylidene}methyl)phenyl acetate |
Molecular Weight: | 402.23 |
Molecular Formula: | C20 H13 Cl2 N O4 |
Smiles: | CC(=O)Oc1cccc(/C=C2/C(=O)OC(/C=C/c3cccc(c3[Cl])[Cl])=N2)c1 |
Stereo: | ACHIRAL |
logP: | 4.4902 |
logD: | 4.4902 |
logSw: | -4.71 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 51.273 |
InChI Key: | XMJQGOGMDPXQGA-UHFFFAOYSA-N |