3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)-N-[4-(trifluoromethyl)phenyl]propanamide
Chemical Structure Depiction of
3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)-N-[4-(trifluoromethyl)phenyl]propanamide
3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)-N-[4-(trifluoromethyl)phenyl]propanamide
Compound characteristics
| Compound ID: | 8020-8350 |
| Compound Name: | 3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-3-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)-N-[4-(trifluoromethyl)phenyl]propanamide |
| Molecular Weight: | 521.45 |
| Molecular Formula: | C25 H22 F3 N O8 |
| Smiles: | CC1=CC(=C(C(CC(Nc2ccc(cc2)C(F)(F)F)=O)c2cc(c3c(c2OC)OCO3)OC)C(=O)O1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5988 |
| logD: | 0.6071 |
| logSw: | -3.9338 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.58 |
| InChI Key: | OPIYHTSWBHWRNZ-HNNXBMFYSA-N |