2-bromo-6-methoxy-4-({2-[2-(2-methoxyphenyl)ethenyl]-5-oxo-1,3-oxazol-4(5H)-ylidene}methyl)phenyl acetate
Chemical Structure Depiction of
2-bromo-6-methoxy-4-({2-[2-(2-methoxyphenyl)ethenyl]-5-oxo-1,3-oxazol-4(5H)-ylidene}methyl)phenyl acetate
2-bromo-6-methoxy-4-({2-[2-(2-methoxyphenyl)ethenyl]-5-oxo-1,3-oxazol-4(5H)-ylidene}methyl)phenyl acetate
Compound characteristics
Compound ID: | K088-2509 |
Compound Name: | 2-bromo-6-methoxy-4-({2-[2-(2-methoxyphenyl)ethenyl]-5-oxo-1,3-oxazol-4(5H)-ylidene}methyl)phenyl acetate |
Molecular Weight: | 472.29 |
Molecular Formula: | C22 H18 Br N O6 |
Smiles: | CC(=O)Oc1c(cc(/C=C2/C(=O)OC(/C=C/c3ccccc3OC)=N2)cc1[Br])OC |
Stereo: | ACHIRAL |
logP: | 4.2351 |
logD: | 4.2351 |
logSw: | -4.5785 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 66.707 |
InChI Key: | RSZRLDFELGKEOI-UHFFFAOYSA-N |