7-[2-(4-methoxyphenyl)-2-oxoethoxy]-4-(trifluoromethyl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-[2-(4-methoxyphenyl)-2-oxoethoxy]-4-(trifluoromethyl)-2H-1-benzopyran-2-one
7-[2-(4-methoxyphenyl)-2-oxoethoxy]-4-(trifluoromethyl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 4579-0189 |
| Compound Name: | 7-[2-(4-methoxyphenyl)-2-oxoethoxy]-4-(trifluoromethyl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 378.3 |
| Molecular Formula: | C19 H13 F3 O5 |
| Smiles: | COc1ccc(cc1)C(COc1ccc2C(=CC(=O)Oc2c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1995 |
| logD: | 3.1995 |
| logSw: | -3.5873 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.664 |
| InChI Key: | PQDPRJPUJJWJEN-UHFFFAOYSA-N |