propyl 4-{[7-hydroxy-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-3-yl]oxy}benzoate
Chemical Structure Depiction of
propyl 4-{[7-hydroxy-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-3-yl]oxy}benzoate
propyl 4-{[7-hydroxy-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-3-yl]oxy}benzoate
Compound characteristics
| Compound ID: | 6737-2364 |
| Compound Name: | propyl 4-{[7-hydroxy-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-3-yl]oxy}benzoate |
| Molecular Weight: | 408.33 |
| Molecular Formula: | C20 H15 F3 O6 |
| Smiles: | CCCOC(c1ccc(cc1)OC1=C(C(F)(F)F)Oc2cc(ccc2C1=O)O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8257 |
| logD: | 4.2466 |
| logSw: | -4.5206 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.28 |
| InChI Key: | HDIKCQXUHIBMJU-UHFFFAOYSA-N |