3-benzyl-4,8-dimethyl-7-(2-oxo-2-phenylethoxy)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-benzyl-4,8-dimethyl-7-(2-oxo-2-phenylethoxy)-2H-1-benzopyran-2-one
3-benzyl-4,8-dimethyl-7-(2-oxo-2-phenylethoxy)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 2259-4050 |
| Compound Name: | 3-benzyl-4,8-dimethyl-7-(2-oxo-2-phenylethoxy)-2H-1-benzopyran-2-one |
| Molecular Weight: | 398.46 |
| Molecular Formula: | C26 H22 O4 |
| Smiles: | CC1=C(Cc2ccccc2)C(=O)Oc2c1ccc(c2C)OCC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3129 |
| logD: | 5.3129 |
| logSw: | -5.5677 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.134 |
| InChI Key: | DJVSAUGXMAAMLE-UHFFFAOYSA-N |