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What is the chemical structure of 2- [4-methyl-5-oxo-4- (propan-2-yl) -4, 5-dihydro-1H-imidazol-2-yl] pyridine-3-carboxylic acid
This is the chemical structure analysis of 2- [4-methyl-5-oxo-4- (isopropyl) -4,5-dihydro-1H-imidazole-2-yl] pyridine-3-carboxylic acid. Looking at its name, it can be seen that this compound is cleverly connected and derived from the two core structures of pyridine and imidazole.
First, the pyridine part, the pyridine ring is connected with a specific substituent at position 2, and position 3 is connected with a carboxyl group. This carboxyl group is acidic and often plays a key role in chemical reactions and biological activities. It can participate in many reactions such as salt formation and esterification.
Looking at the imidazole part, it has a 4,5-dihydro-1H-imidazole structure, with methyl and isopropyl groups at position 4 and carbonyl at position 5. This structure endows the imidazole ring with a unique electron cloud distribution and spatial configuration, which affects the physical, chemical and biological properties of the entire compound.
The two structural units of this compound are connected by 2-position to form a unique spatial structure. The electronic effects of each substituent interact with the steric resistance, which has a significant impact on the stability, solubility, reactivity and biological activity of the compound. In the field of medicinal chemistry, such structures may exhibit unique pharmacological activities due to their ability to fit specific biological targets. In the field of organic synthesis, their complex structures pose challenges and opportunities for synthetic chemists, requiring delicate design routes to successfully prepare.
2- [4-methyl-5-oxo-4- (propan-2-yl) -4, 5-dihydro-1H-imidazol-2-yl] What are the physical properties of pyridine-3-carboxylic acid
2-%5B4-methyl-5-oxo-4-%28propan-2-yl%29-4%2C5-dihydro-1H-imidazol-2-yl%5Dpyridine-3-carboxylic acid is an organic compound with many physical properties.
Looking at its properties, under normal temperature and pressure, this compound often takes a solid form. Due to the specific atoms and chemical bonds in the molecular structure, its appearance is characterized, but the specific color state may vary depending on the purity and crystal form, or it is a white, off-white powder, or a crystalline solid.
When it comes to the melting point, the melting point of this compound is crucial for its identification and purity determination. Experiments have determined that its melting point is in a specific temperature range, which reflects the strength of intermolecular forces and is also an inherent physical property of the compound.
As for solubility, because there are both polar and non-polar parts in the molecule, it shows different solubility behavior in different solvents. In polar organic solvents, such as methanol and ethanol, it can form hydrogen bonds or other interactions with solvent molecules, so it has certain solubility; in non-polar solvents, such as n-hexane and benzene, the solubility is relatively poor, because of the weak force between molecules and non-polar solvents.
In addition, the density of the compound is also one of its physical properties. The density value reflects the mass of the substance per unit volume. This property is related to the accumulation mode and relative molecular weight of the molecule, and is of great significance to its behavior and application in specific systems.
Its stability cannot be ignored. Under conventional environmental conditions, the compound is relatively stable, but under extreme conditions such as high temperature, strong acid, and strong base, or due to the activity of some chemical bonds in the molecular structure, chemical reactions occur, resulting in changes in structure and properties.
The physical properties of this compound are determined by its molecular structure, and these properties are of great significance for its application in chemical synthesis, drug development, etc. According to its physical properties, researchers can choose appropriate methods to separate, purify and characterize it.
2- [4-methyl-5-oxo-4- (propan-2-yl) -4, 5-dihydro-1H-imidazol-2-yl] What is the main use of pyridine-3-carboxylic acid
2-%5B4-methyl-5-oxo-4-%28propan-2-yl%29-4%2C5-dihydro-1H-imidazol-2-yl%5Dpyridine-3-carboxylic acid is an organic compound with a long and complicated name, and this compound has a wide range of uses.
In the field of pharmaceutical research and development, such compounds containing specific heterocyclic structures often have unique biological activities. Or they can be used as potential drug lead compounds, which have been carefully modified and optimized by chemists to improve their affinity and selectivity to specific disease-related targets. For example, for some inflammatory diseases, the compound may use its unique chemical structure to regulate inflammation-related signaling pathways in the body and demonstrate anti-inflammatory effects; or in the research of anti-tumor drugs, by precisely acting on specific targets of tumor cells, inhibiting the proliferation and survival of tumor cells, providing a new direction for the development of anti-cancer drugs.
In the field of materials science, it may be used as a building block for functional materials. Due to its special chemical properties and structure, ingeniously designed and synthesized, it may endow materials with unique electrical and optical properties. For example, it can be used to prepare new photoelectric materials, and in organic Light Emitting Diode (OLED), solar cells and other devices, improve the charge transfer and luminous efficiency of materials, and promote the improvement of material properties.
In chemical synthesis research, this compound can act as a key intermediate. Chemists use it to react with other compounds to construct more complex and diverse molecular structures, which contribute to the development of organic synthesis chemistry and help expand the variety and structural diversity of organic compounds.
What are the synthesis methods of 2- [4-methyl-5-oxo-4- (propan-2-yl) -4, 5-dihydro-1H-imidazol-2-yl] pyridine-3-carboxylic acid
To prepare 2- [4-methyl-5-oxo-4- (isopropyl) -4,5-dihydro-1H-imidazole-2-yl] pyridine-3-carboxylic acid, there are various methods.
First, the condensation reaction can be carried out with imidazole derivatives containing specific substituents via pyridine. First, take a suitable pyridine substrate and put it in a suitable solvent, such as dichloromethane, N, N-dimethylformamide, etc., and add an appropriate base, such as potassium carbonate, triethylamine, etc., to regulate the reaction environment. Then slowly add the reactant containing 4-methyl-5-oxo-4- (isopropyl) -4,5-dihydro-1H-imidazole-2-yl, heat it to a certain temperature, or stir at room temperature, according to the reaction process, can be monitored by thin-layer chromatography. When the reaction reaches the desired degree, it can be purified by extraction, column chromatography, etc., and the product can be obtained.
Second, it can be started by constructing an imidazole ring. The raw material containing pyridine-3-carboxylic acid structure, and the aldehyde and ketone with methyl and isopropyl groups, etc., are used to construct the imidazole ring through multi-step reaction under acidic or basic catalysis. For example, the pyridine-3-carboxylic acid is condensed with a specific aldehyde first, and then cyclized and oxidized under suitable conditions. Each step of the reaction requires fine control of the reaction conditions, such as temperature, pH, and the proportion of reactants. After each step of the reaction, it is also necessary to properly separate and purify, and finally obtain the target product.
Third, the coupling reaction catalyzed by transition metals can also be tried. The reaction of pyridine-3-carboxylic acid halide or borate with imidazole-containing boric acid or borate with transition metal catalysts, such as palladium, is carried out in specific ligand, base and solvent systems. In this process, precise selection of catalysts, ligands, and optimization of reaction parameters are crucial to improving yield and selectivity. After the reaction is completed, regular separation and purification operations are carried out to obtain 2- [4-methyl-5-oxo-4- (isopropyl) -4,5-dihydro-1H-imidazole-2-yl] pyridine-3-carboxylic acid.
2- [4-methyl-5-oxo-4- (propan-2-yl) -4, 5-dihydro-1H-imidazol-2-yl] pyridine-3-carboxylic acid market prospects
There are currently 2- [4-methyl-5-oxo-4- (isopropyl) -4,5-dihydro-1H-imidazole-2-yl] pyridine-3-carboxylic acids, and the market prospect of this compound is worth exploring.
In the field of medicine, many new drug development often relies on these compounds containing imidazole and pyridine structures. Because of its unique chemical structure, or has significant biological activities, such as receptor antagonists, enzyme inhibitors, etc. In the treatment of inflammation, tumors, nervous system diseases, etc., such structural compounds have many achievements, so 2- [4-methyl-5-oxo-4- (isopropyl) -4,5-dihydro-1H-imidazole-2-yl] pyridine-3-carboxylic acid may have broad medical application prospects, and is expected to be developed as innovative drugs to solve the suffering of patients with many diseases.
In the field of pesticides, compounds containing such structures may have good insecticidal and bactericidal activities. With the concept of green environmental protection gradually gaining popularity, it is the general trend to develop high-efficiency, low-toxicity and environmentally friendly pesticides. If this compound can meet this demand, it will also occupy a place in the pesticide market and contribute to the sustainable development of agriculture.
Furthermore, in the field of fine chemicals, it can be used as an intermediate in organic synthesis. Through a series of chemical reactions, a variety of high-value-added fine chemicals are derived to meet the needs of coatings, dyes, fragrances and other industries, and broaden its market application scope.
However, its market development also poses challenges. Optimization of the synthesis process is crucial. If an efficient and low-cost synthesis route can be developed, the competitiveness of the product can be enhanced. And its biological activity and safety need to be deeply studied to meet regulatory requirements and market demand. In summary, although 2- [4-methyl-5-oxo-4- (isopropyl) -4,5-dihydro-1H-imidazole-2-yl] pyridine-3-carboxylic acids face challenges, there are abundant potential opportunities in the fields of medicine, pesticides, and fine chemicals, and the market prospect is promising.