8-[(2-ethylpiperidin-1-yl)methyl]-7-hydroxy-3-(2-methoxyphenyl)-2-(trifluoromethyl)-4H-1-benzopyran-4-one
Chemical Structure Depiction of
8-[(2-ethylpiperidin-1-yl)methyl]-7-hydroxy-3-(2-methoxyphenyl)-2-(trifluoromethyl)-4H-1-benzopyran-4-one
8-[(2-ethylpiperidin-1-yl)methyl]-7-hydroxy-3-(2-methoxyphenyl)-2-(trifluoromethyl)-4H-1-benzopyran-4-one
Compound characteristics
| Compound ID: | 3230-2860 |
| Compound Name: | 8-[(2-ethylpiperidin-1-yl)methyl]-7-hydroxy-3-(2-methoxyphenyl)-2-(trifluoromethyl)-4H-1-benzopyran-4-one |
| Molecular Weight: | 461.48 |
| Molecular Formula: | C25 H26 F3 N O4 |
| Smiles: | CCC1CCCCN1Cc1c(ccc2C(C(=C(C(F)(F)F)Oc12)c1ccccc1OC)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1137 |
| logD: | 3.9329 |
| logSw: | -4.6879 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.685 |
| InChI Key: | KBEDTBQFKKWVJW-HNNXBMFYSA-N |