2-{6-(2H-1,3-benzodioxol-5-yl)-2-[4-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydropyrimidin-4-yl}-6-ethoxyphenol
Chemical Structure Depiction of
2-{6-(2H-1,3-benzodioxol-5-yl)-2-[4-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydropyrimidin-4-yl}-6-ethoxyphenol
2-{6-(2H-1,3-benzodioxol-5-yl)-2-[4-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydropyrimidin-4-yl}-6-ethoxyphenol
Compound characteristics
| Compound ID: | K915-1331 |
| Compound Name: | 2-{6-(2H-1,3-benzodioxol-5-yl)-2-[4-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydropyrimidin-4-yl}-6-ethoxyphenol |
| Molecular Weight: | 484.47 |
| Molecular Formula: | C26 H23 F3 N2 O4 |
| Smiles: | CCOc1cccc(C2CC(c3ccc4c(c3)OCO4)=NC(c3ccc(cc3)C(F)(F)F)N2)c1O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.0802 |
| logD: | 5.1878 |
| logSw: | -5.6549 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.419 |
| InChI Key: | VPVWWYFEBJMXJY-UHFFFAOYSA-N |