8-chloro-7-[2-(3-methoxyphenyl)-2-oxoethoxy]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Chemical Structure Depiction of
8-chloro-7-[2-(3-methoxyphenyl)-2-oxoethoxy]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
8-chloro-7-[2-(3-methoxyphenyl)-2-oxoethoxy]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Compound characteristics
| Compound ID: | Y040-1275 |
| Compound Name: | 8-chloro-7-[2-(3-methoxyphenyl)-2-oxoethoxy]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one |
| Molecular Weight: | 384.81 |
| Molecular Formula: | C21 H17 Cl O5 |
| Smiles: | COc1cccc(c1)C(COc1cc2c(cc1[Cl])C1CCCC=1C(=O)O2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5902 |
| logD: | 4.5902 |
| logSw: | -4.8657 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.552 |
| InChI Key: | ILCWCYVCEYYSNG-UHFFFAOYSA-N |