2-[2-(4-chloro-3-nitrophenyl)-6-(3-methoxyphenyl)-2,3,4,5-tetrahydropyrimidin-4-yl]-6-ethoxyphenol
Chemical Structure Depiction of
2-[2-(4-chloro-3-nitrophenyl)-6-(3-methoxyphenyl)-2,3,4,5-tetrahydropyrimidin-4-yl]-6-ethoxyphenol
2-[2-(4-chloro-3-nitrophenyl)-6-(3-methoxyphenyl)-2,3,4,5-tetrahydropyrimidin-4-yl]-6-ethoxyphenol
Compound characteristics
| Compound ID: | K915-1514 |
| Compound Name: | 2-[2-(4-chloro-3-nitrophenyl)-6-(3-methoxyphenyl)-2,3,4,5-tetrahydropyrimidin-4-yl]-6-ethoxyphenol |
| Molecular Weight: | 481.94 |
| Molecular Formula: | C25 H24 Cl N3 O5 |
| Smiles: | CCOc1cccc(C2CC(c3cccc(c3)OC)=NC(c3ccc(c(c3)[N+]([O-])=O)[Cl])N2)c1O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.5849 |
| logD: | 5.5693 |
| logSw: | -5.6957 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.928 |
| InChI Key: | GGBZJDAOGCYXSZ-UHFFFAOYSA-N |