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What is the chemical structure of 4- (Pyridin-4-yl) -1,3-thiazole-2-thiol?
The chemical structure of 4- (pyridine-4-yl) -1,3-thiazole-2-thiol is particularly important. The structure of this compound is formed by the conjugation of two parts of pyridine and thiazole. The pyridine part is a nitrogen-containing six-membered heterocyclic ring with aromatic properties. Its 4th position is connected to 1,3-thiazole-2-thiol. The 1,3-thiazole ring is a five-membered heterocyclic ring containing nitrogen and sulfur diatoms. 2-thiol group, that is, a thiohydrogen group is connected to the 2nd position of the thiazole ring. This structure gives the compound unique chemical properties. The nitrogen atom on the pyridine ring has a solitary pair of electrons, which can participate in a variety of chemical reactions, such as nucleophilic reactions, coordination reactions, etc. The thiazole ring also affects the reactivity of the compound due to the specific distribution of electron clouds containing sulfur and nitrogen atoms. The sulfur atom of the thiol group has strong nucleophilicity and is easy to react with electrophilic reagents to form new chemical bonds. This structural feature makes 4- (pyridine-4-yl) -1,3-thiazole-2-thiol have potential application value in organic synthesis, pharmaceutical chemistry and other fields, and can provide a key structural unit for the creation of novel compounds and drugs.
What are the main uses of 4- (Pyridin-4-yl) -1,3-thiazole-2-thiol?
4- (Pyridine-4-yl) -1,3-thiazole-2-thiol is an organic compound that has its uses in many fields.
In the field of pharmaceutical research and development, this compound can be used as a key intermediate. Due to its special chemical structure, it can interact with specific targets in organisms. For example, in the development of antibacterial drugs, its structural characteristics can be used to design and synthesize drugs with high affinity and inhibitory activity to specific bacteria to fight the challenge of drug-resistant bacteria. In the exploration of anti-tumor drugs, novel molecules may be constructed based on their structures to target key signaling pathways of cancer cells, achieving the purpose of inhibiting tumor growth and inducing cancer cell apoptosis. < Br >
In the field of materials science, 4- (pyridine-4-yl) -1,3-thiazole-2-thiol also has potential. Due to its heteroatoms such as sulfur and nitrogen, it may be used to prepare functional materials with special properties. For example, in the field of optoelectronic materials, it may be used to regulate the electronic transport and optical properties of materials by its structure to prepare high-efficiency organic Light Emitting Diodes (OLEDs) or solar cell materials to improve the performance and efficiency of devices.
In the field of chemical synthesis, this compound is an important synthetic building block. Due to the existence of thiazole and pyridine structural units, a variety of organic reactions, such as nucleophilic substitution and cyclization, can be used to construct more complex organic molecular structures, providing rich strategies for organic synthetic chemists to create new organic compounds and expand the material library of organic chemistry.
What are the synthesis methods of 4- (Pyridin-4-yl) -1,3-thiazole-2-thiol?
To prepare 4- (pyridine-4-yl) -1,3-thiazole-2-mercaptan, there are two common methods.
First, use 4-pyridine formaldehyde and thioacetamide as starting materials. First, put 4-pyridine formaldehyde and thioacetamide in a suitable reaction vessel, add an appropriate amount of solvent, such as ethanol or dimethylformamide, and heat and stir at a certain temperature. This reaction requires fine temperature control, generally at 60-80 degrees Celsius. During the reaction, the aldehyde group of 4-pyridine formaldehyde interacts with the active group of thioacetamide, and through complex chemical changes, the target product 4- (pyridine-4-yl) -1,3-thiazole-2-thiol is gradually formed. During this process, the polarity of the solvent, the reaction temperature and time all have a great influence on the reaction. If the temperature is too low, the reaction rate is slow; if the temperature is too high, side reactions may occur, resulting in a decrease in product purity. The reaction time is about 4-6 hours. After cooling, filtration, washing, drying and other steps, the crude product can be obtained, and then purified by recrystallization and other means to improve the purity of the product.
Second, 4-halopyridine and 2-mercaptothiazole compounds are used as raw materials. Mix 4-halopyridine (such as 4-chloropyridine or 4-bromopyridine) with 2-mercaptothiazole compounds in the reaction system, and add bases such as potassium carbonate or sodium carbonate to promote the reaction. At the same time, adding a phase transfer catalyst, such as tetrabutylammonium bromide, can speed up the reaction rate. The reaction solvent can be acetonitrile or toluene, and the reaction is reacted under heating reflux conditions. In this reaction, the halogen atom of halopyridine reacts with the mercapto group of 2-mercaptothiazole to form the target molecular structure. The reaction temperature is about 80-100 degrees Celsius, and the reaction time is about 6-8 hours. After the reaction is completed, the organic phase is extracted, washed, dried, and then separated and purified by column chromatography. Pure 4- (pyridine-4-yl) -1,3-thiazole-2-thiol can be obtained. The two methods have their own advantages and disadvantages. In actual operation, it is necessary to comprehensively consider the availability of raw materials, cost, product purity requirements and other factors to choose the appropriate one.
What are the physical properties of 4- (Pyridin-4-yl) -1,3-thiazole-2-thiol?
4- (Pyridine-4-yl) -1,3-thiazole-2-thiol is one of the organic compounds. Its physical properties are quite important and are related to many chemical applications.
First words appearance, this substance is often in a solid state, but the specific form may vary depending on the preparation conditions. Its color, mostly white to light yellow powder, this color characteristic can provide clues for chemists in preliminary identification.
Furthermore, the melting point is one of the key physical properties. Its melting point is about a specific temperature range, which is of great significance for judging the purity and stability of the compound. By accurately measuring the melting point, chemists can gain insight into the stability of the internal structure of the compound and the amount of impurities.
Solubility cannot be ignored either. 4- (pyridine-4-yl) -1,3-thiazole-2-thiol exhibits unique solubility in organic solvents. In some common organic solvents, such as ethanol and dichloromethane, it has certain solubility, which provides convenience for its application in organic synthesis reactions. It can fully contact the reactants in the solution and promote the smooth progress of the reaction.
In addition, its density is also a specific value. Although this value may not always be the primary concern of researchers, in some research scenarios involving accurate measurement and phase equilibrium, accurate determination of density is also indispensable.
In summary, the physical properties of 4- (pyridine-4-yl) -1,3-thiazole-2-thiol, such as appearance, melting point, solubility and density, are interrelated to describe the physical properties of this compound, laying the foundation for its research and application in the field of chemistry.
In which fields is 4- (Pyridin-4-yl) -1,3-thiazole-2-thiol widely used?
4- (pyridine-4-yl) -1,3-thiazole-2-thiol has a wide range of applications in the fields of medicine, materials science and agricultural chemistry.
In the field of medicine, due to its unique chemical structure, it exhibits significant biological activity. It may have antibacterial properties, which can affect the synthesis of some bacterial cell walls, thereby inhibiting the growth and reproduction of bacteria, and is of great potential value in the development of antibacterial drugs. And it also inhibits the growth of some cancer cells, or can block the cell cycle and induce cancer cell apoptosis by interfering with key signaling pathways of cancer cells, providing a new opportunity for the creation of anti-cancer drugs. < Br >
In the field of materials science, this compound can be used as a building block for functional materials. It contains heteroatoms such as sulfur and nitrogen, which can participate in specific chemical reactions and construct materials with special electrical and optical properties. For example, it can prepare sensor materials with high sensitivity to specific gases, and interact with the target gas to trigger electrical or optical signal changes to achieve the detection of harmful gases or specific biomarkers in the environment.
In the field of agricultural chemistry, it can be used to create new pesticides. It has repellent or inhibitory activity against some crop pests or pathogens, can protect crops from pests and diseases, improve crop yield and quality, and is more selective and environmentally friendly than traditional pesticides, reducing the impact on non-target organisms and reducing environmental pollution.
In short, 4- (pyridine-4-yl) -1,3-thiazole-2-thiol plays an important role in the above fields due to its unique structure and diverse activities. With in-depth research, it is expected to expand more application directions and bring more practical benefits.