ethyl 3-(4,8-dimethyl-2-oxo-7-{[3-(trifluoromethyl)phenyl]methoxy}-2H-1-benzopyran-3-yl)propanoate
Chemical Structure Depiction of
ethyl 3-(4,8-dimethyl-2-oxo-7-{[3-(trifluoromethyl)phenyl]methoxy}-2H-1-benzopyran-3-yl)propanoate
ethyl 3-(4,8-dimethyl-2-oxo-7-{[3-(trifluoromethyl)phenyl]methoxy}-2H-1-benzopyran-3-yl)propanoate
Compound characteristics
| Compound ID: | Y041-1814 |
| Compound Name: | ethyl 3-(4,8-dimethyl-2-oxo-7-{[3-(trifluoromethyl)phenyl]methoxy}-2H-1-benzopyran-3-yl)propanoate |
| Molecular Weight: | 448.44 |
| Molecular Formula: | C24 H23 F3 O5 |
| Smiles: | CCOC(CCC1=C(C)c2ccc(c(C)c2OC1=O)OCc1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7631 |
| logD: | 5.7631 |
| logSw: | -5.6843 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.317 |
| InChI Key: | KGIPHIXSOWJISH-UHFFFAOYSA-N |