8-chloro-7-[(3,4,5-trimethoxyphenyl)methoxy]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Chemical Structure Depiction of
8-chloro-7-[(3,4,5-trimethoxyphenyl)methoxy]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
8-chloro-7-[(3,4,5-trimethoxyphenyl)methoxy]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Compound characteristics
| Compound ID: | 4986-0544 |
| Compound Name: | 8-chloro-7-[(3,4,5-trimethoxyphenyl)methoxy]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one |
| Molecular Weight: | 416.86 |
| Molecular Formula: | C22 H21 Cl O6 |
| Smiles: | COc1cc(COc2cc3c(cc2[Cl])C2CCCC=2C(=O)O3)cc(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 4.5621 |
| logD: | 4.5621 |
| logSw: | -4.7159 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.739 |
| InChI Key: | OLMXZAPSAZRKGU-UHFFFAOYSA-N |