7-[2-(3-fluoro-4-methoxyphenyl)-2-oxoethoxy]-6-methyl-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Chemical Structure Depiction of
7-[2-(3-fluoro-4-methoxyphenyl)-2-oxoethoxy]-6-methyl-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
7-[2-(3-fluoro-4-methoxyphenyl)-2-oxoethoxy]-6-methyl-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Compound characteristics
| Compound ID: | Y040-2054 |
| Compound Name: | 7-[2-(3-fluoro-4-methoxyphenyl)-2-oxoethoxy]-6-methyl-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one |
| Molecular Weight: | 382.39 |
| Molecular Formula: | C22 H19 F O5 |
| Smiles: | Cc1c(ccc2C3CCCC=3C(=O)Oc12)OCC(c1ccc(c(c1)F)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1476 |
| logD: | 4.1476 |
| logSw: | -4.4726 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.322 |
| InChI Key: | NKMWWJZIEKHCJY-UHFFFAOYSA-N |