2-{2-[4-(acetyloxy)-2-bromo-5-methoxyphenyl]ethenyl}quinolin-8-yl acetate
Chemical Structure Depiction of
2-{2-[4-(acetyloxy)-2-bromo-5-methoxyphenyl]ethenyl}quinolin-8-yl acetate
2-{2-[4-(acetyloxy)-2-bromo-5-methoxyphenyl]ethenyl}quinolin-8-yl acetate
Compound characteristics
| Compound ID: | 4896-2792 |
| Compound Name: | 2-{2-[4-(acetyloxy)-2-bromo-5-methoxyphenyl]ethenyl}quinolin-8-yl acetate |
| Molecular Weight: | 456.29 |
| Molecular Formula: | C22 H18 Br N O5 |
| Smiles: | CC(=O)Oc1cc(c(/C=C/c2ccc3cccc(c3n2)OC(C)=O)cc1OC)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.344 |
| logD: | 4.344 |
| logSw: | -4.5682 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.869 |
| InChI Key: | ZCPABDKUHSGZAC-UHFFFAOYSA-N |