ethyl 2-{[3-(2,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}butanoate
Chemical Structure Depiction of
ethyl 2-{[3-(2,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}butanoate
ethyl 2-{[3-(2,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}butanoate
Compound characteristics
| Compound ID: | 4358-3589 |
| Compound Name: | ethyl 2-{[3-(2,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}butanoate |
| Molecular Weight: | 396.44 |
| Molecular Formula: | C23 H24 O6 |
| Smiles: | CCC(C(=O)OCC)Oc1ccc2C(C(=COc2c1)Oc1cc(C)ccc1C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1074 |
| logD: | 5.1074 |
| logSw: | -4.9536 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.082 |
| InChI Key: | SFGVMJRHTPQJRX-SFHVURJKSA-N |