7-hydroxy-3-(3-methylphenoxy)-8-[(3-methylpiperidin-1-yl)methyl]-2-(trifluoromethyl)-4H-1-benzopyran-4-one
Chemical Structure Depiction of
7-hydroxy-3-(3-methylphenoxy)-8-[(3-methylpiperidin-1-yl)methyl]-2-(trifluoromethyl)-4H-1-benzopyran-4-one
7-hydroxy-3-(3-methylphenoxy)-8-[(3-methylpiperidin-1-yl)methyl]-2-(trifluoromethyl)-4H-1-benzopyran-4-one
Compound characteristics
| Compound ID: | 6649-0956 |
| Compound Name: | 7-hydroxy-3-(3-methylphenoxy)-8-[(3-methylpiperidin-1-yl)methyl]-2-(trifluoromethyl)-4H-1-benzopyran-4-one |
| Molecular Weight: | 447.45 |
| Molecular Formula: | C24 H24 F3 N O4 |
| Smiles: | CC1CCCN(C1)Cc1c(ccc2C(C(=C(C(F)(F)F)Oc12)Oc1cccc(C)c1)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3698 |
| logD: | 4.458 |
| logSw: | -5.1302 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.513 |
| InChI Key: | ZWRRQCIOXZGFSS-HNNXBMFYSA-N |