3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl 3,4-dimethoxybenzoate
Chemical Structure Depiction of
3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl 3,4-dimethoxybenzoate
3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl 3,4-dimethoxybenzoate
Compound characteristics
| Compound ID: | 4300-0896 |
| Compound Name: | 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl 3,4-dimethoxybenzoate |
| Molecular Weight: | 516.43 |
| Molecular Formula: | C26 H19 F3 O8 |
| Smiles: | COc1ccc(cc1)OC1=C(C(F)(F)F)Oc2cc(ccc2C1=O)OC(c1ccc(c(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7663 |
| logD: | 4.7663 |
| logSw: | -4.7071 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 70.797 |
| InChI Key: | NQEFOCNWDPCIRG-UHFFFAOYSA-N |