2-{2-[2-(acetyloxy)-5-bromophenyl]ethenyl}quinolin-8-yl acetate
Chemical Structure Depiction of
2-{2-[2-(acetyloxy)-5-bromophenyl]ethenyl}quinolin-8-yl acetate
2-{2-[2-(acetyloxy)-5-bromophenyl]ethenyl}quinolin-8-yl acetate
Compound characteristics
| Compound ID: | 5704-0142 |
| Compound Name: | 2-{2-[2-(acetyloxy)-5-bromophenyl]ethenyl}quinolin-8-yl acetate |
| Molecular Weight: | 426.26 |
| Molecular Formula: | C21 H16 Br N O4 |
| Smiles: | CC(=O)Oc1ccc(cc1/C=C/c1ccc2cccc(c2n1)OC(C)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.4924 |
| logD: | 4.4923 |
| logSw: | -4.6526 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.239 |
| InChI Key: | VAPGUTWYXJCQSB-UHFFFAOYSA-N |