ethyl 2-[(8-benzoyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]butanoate
Chemical Structure Depiction of
ethyl 2-[(8-benzoyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]butanoate
ethyl 2-[(8-benzoyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]butanoate
Compound characteristics
| Compound ID: | 4270-0401 |
| Compound Name: | ethyl 2-[(8-benzoyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]butanoate |
| Molecular Weight: | 394.42 |
| Molecular Formula: | C23 H22 O6 |
| Smiles: | CCC(C(=O)OCC)Oc1ccc2C(C)=CC(=O)Oc2c1C(c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6215 |
| logD: | 4.6215 |
| logSw: | -4.6609 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 61.31 |
| InChI Key: | QQRRKGGPRVEOQG-KRWDZBQOSA-N |