3-(3,4-dimethoxyphenyl)-7-[(2-methylphenyl)methoxy]-2-(trifluoromethyl)-4H-1-benzopyran-4-one
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-7-[(2-methylphenyl)methoxy]-2-(trifluoromethyl)-4H-1-benzopyran-4-one
3-(3,4-dimethoxyphenyl)-7-[(2-methylphenyl)methoxy]-2-(trifluoromethyl)-4H-1-benzopyran-4-one
Compound characteristics
| Compound ID: | 5976-1899 |
| Compound Name: | 3-(3,4-dimethoxyphenyl)-7-[(2-methylphenyl)methoxy]-2-(trifluoromethyl)-4H-1-benzopyran-4-one |
| Molecular Weight: | 470.44 |
| Molecular Formula: | C26 H21 F3 O5 |
| Smiles: | Cc1ccccc1COc1ccc2C(C(=C(C(F)(F)F)Oc2c1)c1ccc(c(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8246 |
| logD: | 5.8246 |
| logSw: | -5.5983 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.766 |
| InChI Key: | ZZAAHNZDTWGIJZ-UHFFFAOYSA-N |