methyl {7-[(4-bromo-2-fluorophenyl)methoxy]-6-chloro-4-methyl-2-oxo-2H-1-benzopyran-3-yl}acetate
Chemical Structure Depiction of
methyl {7-[(4-bromo-2-fluorophenyl)methoxy]-6-chloro-4-methyl-2-oxo-2H-1-benzopyran-3-yl}acetate
methyl {7-[(4-bromo-2-fluorophenyl)methoxy]-6-chloro-4-methyl-2-oxo-2H-1-benzopyran-3-yl}acetate
Compound characteristics
| Compound ID: | Y040-2335 |
| Compound Name: | methyl {7-[(4-bromo-2-fluorophenyl)methoxy]-6-chloro-4-methyl-2-oxo-2H-1-benzopyran-3-yl}acetate |
| Molecular Weight: | 469.69 |
| Molecular Formula: | C20 H15 Br Cl F O5 |
| Smiles: | CC1=C(CC(=O)OC)C(=O)Oc2cc(c(cc12)[Cl])OCc1ccc(cc1F)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.4383 |
| logD: | 5.4383 |
| logSw: | -6.0283 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.053 |
| InChI Key: | FAFWKHHYVSGDBZ-UHFFFAOYSA-N |