3-(2-chlorophenoxy)-7-hydroxy-8-[(3-methylpiperidin-1-yl)methyl]-2-(trifluoromethyl)-4H-1-benzopyran-4-one
Chemical Structure Depiction of
3-(2-chlorophenoxy)-7-hydroxy-8-[(3-methylpiperidin-1-yl)methyl]-2-(trifluoromethyl)-4H-1-benzopyran-4-one
3-(2-chlorophenoxy)-7-hydroxy-8-[(3-methylpiperidin-1-yl)methyl]-2-(trifluoromethyl)-4H-1-benzopyran-4-one
Compound characteristics
| Compound ID: | 6649-0960 |
| Compound Name: | 3-(2-chlorophenoxy)-7-hydroxy-8-[(3-methylpiperidin-1-yl)methyl]-2-(trifluoromethyl)-4H-1-benzopyran-4-one |
| Molecular Weight: | 467.87 |
| Molecular Formula: | C23 H21 Cl F3 N O4 |
| Smiles: | CC1CCCN(C1)Cc1c(ccc2C(C(=C(C(F)(F)F)Oc12)Oc1ccccc1[Cl])=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3432 |
| logD: | 4.4314 |
| logSw: | -5.3427 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.6 |
| InChI Key: | YBBDCPBIUZPMRL-ZDUSSCGKSA-N |