3-(3,4-dimethoxyphenyl)-7-[(prop-2-en-1-yl)oxy]-2-(trifluoromethyl)-4H-1-benzopyran-4-one
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-7-[(prop-2-en-1-yl)oxy]-2-(trifluoromethyl)-4H-1-benzopyran-4-one
3-(3,4-dimethoxyphenyl)-7-[(prop-2-en-1-yl)oxy]-2-(trifluoromethyl)-4H-1-benzopyran-4-one
Compound characteristics
| Compound ID: | 3643-2284 |
| Compound Name: | 3-(3,4-dimethoxyphenyl)-7-[(prop-2-en-1-yl)oxy]-2-(trifluoromethyl)-4H-1-benzopyran-4-one |
| Molecular Weight: | 406.36 |
| Molecular Formula: | C21 H17 F3 O5 |
| Smiles: | COc1ccc(cc1OC)C1=C(C(F)(F)F)Oc2cc(ccc2C1=O)OCC=C |
| Stereo: | ACHIRAL |
| logP: | 4.363 |
| logD: | 4.363 |
| logSw: | -4.4922 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.956 |
| InChI Key: | BWWZLZJCUVTFOW-UHFFFAOYSA-N |