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What is the chemical structure of 5-Fluoro-N- [6-fluoro-5- [ (5-methyl-1H-pyrrolo [2,3-b] pyridin-3-yl) methyl] -2-pyridinyl] -2-methoxy-3-pyridinemethanamine?
5 - Fluoro - N - [6 - fluoro - 5 - [ (5 - methyl - 1H - pyrrolo [2,3 - b] pyridin - 3 - yl) methyl] - 2 - pyridinyl] - 2 - methoxy - 3 - pyridinemethanamine is an organic compound. The chemical structure of this compound is quite complex, and it is formed by connecting multiple specific groups in a specific way.
Looking at its structure, the main body is spliced by nitrogen-containing heterocyclic pyridine and pyrrolido-pyridine. Among them, the pyridine is modified by fluorine atoms, methoxy groups and other groups. On the basis of the fluorine-substituted pyridine ring at the 6-position, the 5-position is connected to the methyl group of the 5-methyl-1H-pyrrolido [2,3-b] pyridine-3-group through methylene. In the 3-position of the other pyridine ring, it is connected by methylamino group, and there is a methoxy group at the 2-position of the pyridine ring, and a fluorine atom at the 5-position.
As a whole, this compound has a unique structure. The spatial arrangement and interaction of each group endow it with specific chemical and physical properties, which has a crucial impact on its potential applications in organic synthesis, drug development and other fields. Each group interacts with each other, or changes the distribution of electron clouds, or affects the polarity of molecules, which in turn affects their reactivity, solubility and biological activity.
What are the main physical properties of 5-Fluoro-N- [6-fluoro-5- [ (5-methyl-1H-pyrrolo [2,3-b] pyridin-3-yl) methyl] -2-pyridinyl] -2-methoxy-3-pyridinemethanamine?
5 - Fluoro - N - [6 - fluoro - 5 - [ (5 - methyl - 1H - pyrrolo [2,3 - b] pyridin - 3 - yl) methyl] - 2 - pyridinyl] - 2 - methoxy - 3 - pyridinemethanamine is an organic compound. Looking at its physical properties, this compound is mostly solid at room temperature, and its molecular interaction is quite strong, resulting in orderly molecular arrangement.
When it comes to the melting boiling point, there are many polar groups in the molecule, such as fluorine atoms, methoxy groups and amine groups. These polar groups form hydrogen bonds and dipole-dipole interactions between molecules, so the melting boiling point is relatively high. The specific value may vary depending on the purity and experimental conditions.
In terms of solubility, because the molecule contains polar parts, it should have a certain solubility in polar organic solvents such as methanol, ethanol, dichloromethane, etc. However, the molecule also contains a large non-polar aromatic ring structure, so the solubility in water may be limited. Because water is a strong polar solvent, the interaction between water and non-polar aromatic rings is weak.
From the perspective of stability, the aromatic ring structure in the molecule gives it a certain conjugate stability. However, the presence of fluorine atoms enhances the electron cloud density of the molecule, but also changes some chemical bond activities. For example, the chemical bonds of carbon atoms connected to fluorine atoms may be more prone to reaction under specific conditions. Therefore, when storing and using, it is necessary to avoid extreme conditions such as high temperature, strong acid, and strong base to prevent chemical reactions from causing structural changes.
What is the synthesis method of 5-Fluoro-N- [6-fluoro-5- [ (5-methyl-1H-pyrrolo [2,3-b] pyridin-3-yl) methyl] -2-pyridinyl] -2-methoxy-3-pyridinemethanamine?
5 - Fluoro - N - [6 - fluoro - 5 - [ (5 - methyl - 1H - pyrrolo [2,3 - b] pyridin - 3 - yl) methyl] - 2 - pyridinyl] - 2 - methoxy - 3 - pyridinemethanamine is a complex organic compound. The synthesis method is as follows:
The starting material should be selected as pyridine and pyrrolido pyridine derivatives with corresponding substituents. First, a fluorination reaction is carried out at a specific position on the pyridine ring. Under appropriate reaction conditions, fluorine atoms can be introduced at the 5th and 6th positions of the pyridine ring using suitable fluorination reagents, such as Selectfluor.
Subsequently, for the 5-methyl-1H-pyrrolido [2,3-b] pyridine-3-position, a halogenated reaction, such as the use of N-bromosuccinimide (NBS) in the presence of light or an initiator, halogen atoms are introduced to generate 5-methyl-3-halo-1H-pyrrolido [2,3-b] pyridine derivatives.
Next, the halogen is used to carry out a nucleophilic substitution reaction with the aldehyde-containing pyridine derivative. For example, in the presence of a base (such as potassium carbonate, etc.), it is reacted in a suitable organic solvent (such as N, N-dimethylformamide, DMF) to generate an intermediate containing a connecting structure.
For a specific position on the pyridine ring in the intermediate, a methoxylation reaction is carried out. The system of iodomethane and base can be used to convert the 2-position hydroxyl group into a methoxy group.
Finally, the methylamine group is introduced at the 3-position through a suitable reductive amination reaction. If a reducing agent such as sodium borohydride or sodium cyanoborohydride is used, it is reacted with the corresponding aldehyde or ketone under weakly acidic conditions to finally obtain the target product 5-Fluoro-N - [6-fluoro-5- [ (5-methyl-1H-pyrrolo [2,3-b] pyridin-3-yl) methyl] - 2-pyridinyl] - 2-methoxy-3-pyridinemethanamine. Each step of the reaction requires strict control of the reaction conditions, including temperature, reaction time, and ratio of reactants, to ensure high yield and purity.
What are the applications of 5-Fluoro-N- [6-fluoro-5- [ (5-methyl-1H-pyrrolo [2,3-b] pyridin-3-yl) methyl] -2-pyridinyl] -2-methoxy-3-pyridinemethanamine?
5 - Fluoro - N - [6 - fluoro - 5 - [ (5 - methyl - 1H - pyrrolo [2,3 - b] pyridin - 3 - yl) methyl] - 2 - pyridinyl] - 2 - methoxy - 3 - pyridinemethanamine is a complex organic compound. This compound may have significant uses in the field of pharmaceutical research and development.
In the field of pharmaceutical chemistry, such compounds containing nitrogen heterocycles and multiple substituents often have unique biological activities. Many functional groups interact in their structures, giving the compound the possibility of binding to specific targets in organisms. If it can precisely dock biological macromolecules such as proteins and enzymes, or can regulate key physiological processes in organisms, it is expected to be developed as a drug for the treatment of specific diseases.
In the field of anti-tumor, such structures may interfere with the proliferation, differentiation and metastasis of tumor cells related signaling pathways. Due to its unique chemical structure, it may specifically act on tumor cell surface receptors or key enzymes in cells, inhibiting tumor cell growth, but has little effect on normal cells, improving therapeutic effect and reducing side effects.
In the treatment of neurological diseases, it may regulate neurotransmitter transmission and nerve cell activity. By binding to receptors on the surface of nerve cells, it can affect nerve signaling, or provide new opportunities for the treatment of neurodegenerative diseases such as Parkinson's disease and Alzheimer's disease.
In addition, in the field of anti-infection, it may play a role in targeting specific metabolic pathways or structural targets of pathogens. Or interfere with bacterial cell wall synthesis and inhibit the activity of virus replication-related enzymes, showing the potential of antibacterial and antiviral.
What is the safety and toxicity of 5-Fluoro-N- [6-fluoro-5- [ (5-methyl-1H-pyrrolo [2,3-b] pyridin-3-yl) methyl] -2-pyridinyl] -2-methoxy-3-pyridinemethanamine?
5 - Fluoro - N - [6 - fluoro - 5 - [ (5 - methyl - 1H - pyrrolo [2,3 - b] pyridin - 3 - yl) methyl] - 2 - pyridinyl] - 2 - methoxy - 3 - pyridinemethanamine, this is a complex organic compound. However, it is difficult to make a definitive conclusion about its safety and toxicity, and it must be determined by various experiments and studies.
Many cases in the past have shown that the safety and toxicity of organic compounds are affected by multiple factors. First, the structural characteristics of the compound are quite critical. This compound has a complex structure and contains fluorine, methoxy and other functional groups, which may affect its chemical and biological activities. The introduction of fluorine atoms often changes the lipid solubility and stability of the compound, but may also increase its toxicity. The presence of methoxy groups may affect the polarity and metabolic pathways of the molecule.
Second, differences in experimental subjects also have a significant impact on the results. Taking animal experiments as an example, different animal species may have very different reactions to the same compound. The physiological structure and metabolic mechanism of commonly used experimental animals such as mice and rats are different from those of humans. Therefore, the toxicity data obtained from animal experiments may not be fully extrapolated to humans.
Third, the route of exposure and the dose are crucial. Different exposure routes such as oral administration, inhalation or skin contact, the way in which the compound enters the body and the degree of absorption are different. And the dose size is often positively correlated with the toxic response. At low doses, only mild reactions may be triggered, and at high doses, serious toxic effects may be caused.
However, there are no detailed and conclusive safety and toxicity studies for this specific compound. It may be necessary to explore its effects on the proliferation and apoptosis of different cell lines through cell experiments; followed by animal experiments to evaluate acute toxicity, sub-chronic toxicity and chronic toxicity. Ultimately, human clinical trials may be required to comprehensively and accurately determine its safety and potential toxicity to humans. Only in this way can the safety and toxicity of 5 - Fluoro - N - [6 - fluoro - 5 - [ (5 - methyl - 1H - pyrrolo [2,3 - b] pyridin - 3 - yl) methyl] - 2 - pyridinyl] - 2 - methoxy - 3 - pyridinemethanamine be known.