6-bromo-3-[3-(2-chloro-7-methylquinolin-3-yl)prop-2-enoyl]-4-phenylquinolin-2(1H)-one
Chemical Structure Depiction of
6-bromo-3-[3-(2-chloro-7-methylquinolin-3-yl)prop-2-enoyl]-4-phenylquinolin-2(1H)-one
6-bromo-3-[3-(2-chloro-7-methylquinolin-3-yl)prop-2-enoyl]-4-phenylquinolin-2(1H)-one
Compound characteristics
| Compound ID: | 0647-0096 |
| Compound Name: | 6-bromo-3-[3-(2-chloro-7-methylquinolin-3-yl)prop-2-enoyl]-4-phenylquinolin-2(1H)-one |
| Molecular Weight: | 529.82 |
| Molecular Formula: | C28 H18 Br Cl N2 O2 |
| Smiles: | Cc1ccc2cc(/C=C/C(C3=C(c4ccccc4)c4cc(ccc4NC3=O)[Br])=O)c(nc2c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 7.1916 |
| logD: | 6.1774 |
| logSw: | -6.3411 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.788 |
| InChI Key: | MZFRNIQTCZDKBU-UHFFFAOYSA-N |