methyl {5-[2-([1,1'-biphenyl]-4-yl)-2-oxoethoxy]-4,7-dimethyl-2-oxo-2H-1-benzopyran-3-yl}acetate
Chemical Structure Depiction of
methyl {5-[2-([1,1'-biphenyl]-4-yl)-2-oxoethoxy]-4,7-dimethyl-2-oxo-2H-1-benzopyran-3-yl}acetate
methyl {5-[2-([1,1'-biphenyl]-4-yl)-2-oxoethoxy]-4,7-dimethyl-2-oxo-2H-1-benzopyran-3-yl}acetate
Compound characteristics
| Compound ID: | Y040-3513 |
| Compound Name: | methyl {5-[2-([1,1'-biphenyl]-4-yl)-2-oxoethoxy]-4,7-dimethyl-2-oxo-2H-1-benzopyran-3-yl}acetate |
| Molecular Weight: | 456.49 |
| Molecular Formula: | C28 H24 O6 |
| Smiles: | CC1=C(CC(=O)OC)C(=O)Oc2cc(C)cc(c12)OCC(c1ccc(cc1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3889 |
| logD: | 5.3889 |
| logSw: | -5.6301 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 62.029 |
| InChI Key: | HKKOHQYIUUXTIP-UHFFFAOYSA-N |