ethyl 3-(3,4-dimethoxyphenyl)-7-[(4-fluorophenyl)methoxy]-4-oxo-4H-1-benzopyran-2-carboxylate
Chemical Structure Depiction of
ethyl 3-(3,4-dimethoxyphenyl)-7-[(4-fluorophenyl)methoxy]-4-oxo-4H-1-benzopyran-2-carboxylate
ethyl 3-(3,4-dimethoxyphenyl)-7-[(4-fluorophenyl)methoxy]-4-oxo-4H-1-benzopyran-2-carboxylate
Compound characteristics
| Compound ID: | 6737-1397 |
| Compound Name: | ethyl 3-(3,4-dimethoxyphenyl)-7-[(4-fluorophenyl)methoxy]-4-oxo-4H-1-benzopyran-2-carboxylate |
| Molecular Weight: | 478.47 |
| Molecular Formula: | C27 H23 F O7 |
| Smiles: | CCOC(C1=C(C(c2ccc(cc2O1)OCc1ccc(cc1)F)=O)c1ccc(c(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8055 |
| logD: | 4.8055 |
| logSw: | -4.8664 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.52 |
| InChI Key: | VQWQUGCZWAVKEH-UHFFFAOYSA-N |