5-[(2-bromo-4-fluorophenyl)methoxy]-4,7-dimethyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
5-[(2-bromo-4-fluorophenyl)methoxy]-4,7-dimethyl-2H-1-benzopyran-2-one
5-[(2-bromo-4-fluorophenyl)methoxy]-4,7-dimethyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-3845 |
| Compound Name: | 5-[(2-bromo-4-fluorophenyl)methoxy]-4,7-dimethyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 377.21 |
| Molecular Formula: | C18 H14 Br F O3 |
| Smiles: | CC1=CC(=O)Oc2cc(C)cc(c12)OCc1ccc(cc1[Br])F |
| Stereo: | ACHIRAL |
| logP: | 4.8687 |
| logD: | 4.8687 |
| logSw: | -4.9194 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.9599 |
| InChI Key: | LMRCXCVGHKYCIO-UHFFFAOYSA-N |