7-[2-(3-fluoro-4-methoxyphenyl)-2-oxo-1-phenylethoxy]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Chemical Structure Depiction of
7-[2-(3-fluoro-4-methoxyphenyl)-2-oxo-1-phenylethoxy]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
7-[2-(3-fluoro-4-methoxyphenyl)-2-oxo-1-phenylethoxy]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Compound characteristics
| Compound ID: | Y040-1220 |
| Compound Name: | 7-[2-(3-fluoro-4-methoxyphenyl)-2-oxo-1-phenylethoxy]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one |
| Molecular Weight: | 444.46 |
| Molecular Formula: | C27 H21 F O5 |
| Smiles: | COc1ccc(cc1F)C(C(c1ccccc1)Oc1ccc2C3CCCC=3C(=O)Oc2c1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2863 |
| logD: | 5.2863 |
| logSw: | -5.3959 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.048 |
| InChI Key: | KQCMJONRVBMLTH-AREMUKBSSA-N |