6-bromo-3-[3-(5-methylfuran-2-yl)prop-2-enoyl]-4-phenylquinolin-2(1H)-one
Chemical Structure Depiction of
6-bromo-3-[3-(5-methylfuran-2-yl)prop-2-enoyl]-4-phenylquinolin-2(1H)-one
6-bromo-3-[3-(5-methylfuran-2-yl)prop-2-enoyl]-4-phenylquinolin-2(1H)-one
Compound characteristics
| Compound ID: | 0800-0957 |
| Compound Name: | 6-bromo-3-[3-(5-methylfuran-2-yl)prop-2-enoyl]-4-phenylquinolin-2(1H)-one |
| Molecular Weight: | 434.29 |
| Molecular Formula: | C23 H16 Br N O3 |
| Smiles: | Cc1ccc(/C=C/C(C2=C(c3ccccc3)c3cc(ccc3NC2=O)[Br])=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 5.5542 |
| logD: | 4.54 |
| logSw: | -5.5579 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.083 |
| InChI Key: | XLGJFDCEFSNHSL-UHFFFAOYSA-N |