1-(6-bromo-2-methyl-4-phenylquinolin-3-yl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-en-1-one
Chemical Structure Depiction of
1-(6-bromo-2-methyl-4-phenylquinolin-3-yl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-en-1-one
1-(6-bromo-2-methyl-4-phenylquinolin-3-yl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-en-1-one
Compound characteristics
| Compound ID: | 0800-0930 |
| Compound Name: | 1-(6-bromo-2-methyl-4-phenylquinolin-3-yl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-en-1-one |
| Molecular Weight: | 486.36 |
| Molecular Formula: | C27 H20 Br N O3 |
| Smiles: | Cc1c(C(/C=C/c2ccc3c(c2)OCCO3)=O)c(c2ccccc2)c2cc(ccc2n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 6.1716 |
| logD: | 6.1716 |
| logSw: | -5.6584 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.673 |
| InChI Key: | JNJCAFGFXJZGQX-UHFFFAOYSA-N |