3-benzyl-5-[2-(4-fluorophenyl)-2-oxoethoxy]-4,7-dimethyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-benzyl-5-[2-(4-fluorophenyl)-2-oxoethoxy]-4,7-dimethyl-2H-1-benzopyran-2-one
3-benzyl-5-[2-(4-fluorophenyl)-2-oxoethoxy]-4,7-dimethyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 4182-0326 |
| Compound Name: | 3-benzyl-5-[2-(4-fluorophenyl)-2-oxoethoxy]-4,7-dimethyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 416.45 |
| Molecular Formula: | C26 H21 F O4 |
| Smiles: | CC1=C(Cc2ccccc2)C(=O)Oc2cc(C)cc(c12)OCC(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6356 |
| logD: | 5.6356 |
| logSw: | -5.631 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.45 |
| InChI Key: | PNQCECPMOZENOO-UHFFFAOYSA-N |