9-[(2-chloro-4-fluorophenyl)methoxy]-7-methyl-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Chemical Structure Depiction of
9-[(2-chloro-4-fluorophenyl)methoxy]-7-methyl-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
9-[(2-chloro-4-fluorophenyl)methoxy]-7-methyl-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Compound characteristics
| Compound ID: | 4182-0669 |
| Compound Name: | 9-[(2-chloro-4-fluorophenyl)methoxy]-7-methyl-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one |
| Molecular Weight: | 358.8 |
| Molecular Formula: | C20 H16 Cl F O3 |
| Smiles: | Cc1cc(c2C3CCCC=3C(=O)Oc2c1)OCc1ccc(cc1[Cl])F |
| Stereo: | ACHIRAL |
| logP: | 5.2927 |
| logD: | 5.2927 |
| logSw: | -6.1246 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 28.7609 |
| InChI Key: | QGHZIFVWZURMSE-UHFFFAOYSA-N |