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What is the chemical structure of 1- {2- [ (4-Chlorobenzyl) sulfanyl] -2- (2,4-dichlorophenyl) ethyl} -1H-imidazole?
1 - {2 - [ (4-chlorobenzyl) thio] -2 - (2,4-dichlorophenyl) ethyl} -1H -imidazole, the structure of this compound is based on an imidazole ring. The 1H -imidazole ring is a five-membered heterocyclic ring containing two nitrogen atoms, which is aromatic.
is connected to a complex side chain at the first position of the imidazole ring. The side chain starts with monoethyl, and is connected with (4-chlorobenzyl) thio on one side and 2,4-dichlorophenyl on the other side. ( In the 4-chlorobenzyl) thio group, the benzyl group is benzyl, and the fourth position of the benzene ring is replaced by a chlorine atom, and the methylene of the benzyl group is connected to the sulfur atom, which is then connected to the second carbon of the ethyl group. And 2,4-dichlorophenyl, that is, the second and fourth positions of the benzene ring have a chlorine atom substituted, and then connected to the second carbon of the ethyl group.
In this way, each atom is connected according to a specific pricing bond rule to form a unique chemical structure of 1 - {2 - [ (4-chlorobenzyl) thio] -2 - (2,4-dichlorophenyl) ethyl} -1H -imidazole. In this structure, different groups interact with each other, giving the compound specific physical and chemical properties, which may have unique applications in organic synthesis, medicinal chemistry, and other fields.
What are the physical properties of 1- {2- [ (4-Chlorobenzyl) sulfanyl] -2- (2,4-dichlorophenyl) ethyl} -1H-imidazole?
1 - {2 - [ (4 - Chlorobenzyl) sulfanyl] -2 - (2,4 - dichlorophenyl) ethyl} -1H - imidazole is an organic compound with unique physical properties.
Looking at its morphology, it is a solid under normal conditions, and it forms a relatively regular lattice structure due to relatively strong intermolecular forces. In terms of melting point, due to various interactions in the molecule, such as van der Waals force, weak interaction between chlorine atoms, etc., the melting point is quite high, or above 100 degrees Celsius. The boiling point of this compound is also not low, and more energy is required for gasification due to intermolecular forces and relatively large molecular weights. In terms of solubility, its molecules contain polar imidazole rings, non-polar aromatic rings, and halogenated benzene structures, and have different solubility in organic solvents. In polar organic solvents such as ethanol, the polar part forms hydrogen bonds or dipole-dipole interactions with ethanol, or has a certain solubility; in non-polar organic solvents such as n-hexane, the non-polar aromatic ring part interacts weakly with n-hexane, and the solubility may be limited.
In terms of density, the chlorine atom in the molecule has a large atomic weight, resulting in a relatively large density or greater than that of common organic solvents. And this compound has certain stability, and the aromatic system of the aromatic ring and the imidazole ring make its chemical properties relatively stable, and it is not easy to decompose under normal conditions. However, under special conditions such as strong oxidizing agent, strong acid and strong base, some chemical bonds in its structure may be affected and react.
What are the main uses of 1- {2- [ (4-Chlorobenzyl) sulfanyl] -2- (2,4-dichlorophenyl) ethyl} -1H-imidazole?
1 - {2 - [ (4-chlorobenzyl) thio] -2 - (2,4-dichlorophenyl) ethyl} -1H -imidazole is widely used in the field of pharmaceutical and chemical industry.
In terms of its use in medicine, it is often used as the key to active ingredients. In terms of antifungal ability, many antifungal drugs can be prepared. It can interfere with the formation of fungal cell membranes, and the structure of Gainimidazole can inhibit the key enzyme of ergosterol synthesis in fungal cells, damage the cell membrane, inhibit the growth of fungi, and then kill fungi. It is effective for common superficial and deep fungal diseases. < Br >
In the field of chemical industry, it is also an important intermediate for organic synthesis. With its unique chemical structure, it can undergo a variety of chemical reactions and combine with various reagents to synthesize more complex and functional organic compounds. It plays an indispensable role in materials science, fine chemical product preparation, etc., laying the foundation for the creation of new high-performance materials and fine chemicals.
What are the synthesis methods of 1- {2- [ (4-Chlorobenzyl) sulfanyl] -2- (2,4-dichlorophenyl) ethyl} -1H-imidazole?
1 - {2 - [ (4-chlorobenzyl) thio] -2 - (2,4-dichlorophenyl) ethyl} -1H - imidazole synthesis method, there are many methods, and each has its own ingenuity.
First, starting from the starting material, with 2,4-dichlorobenzene as the base, first with halogenated hydrocarbons such as 4-chlorobenzyl halides, under the catalysis of base, nucleophilic substitution occurs, so that 4-chlorobenzyl is connected to the α-carbon of 2,4-dichlorobenzene to form an intermediate containing sulfide structure. Subsequently, the intermediate and imidazole undergo a condensation reaction under appropriate conditions to form an imidazole ring, and the target product is obtained. In this process, the control of reaction conditions is extremely critical. The type and dosage of bases, reaction temperature and time, etc., all have a great impact on the reaction process and product yield.
Furthermore, 4-chlorobenzyl mercaptan and 2 - (2,4-dichlorophenyl) ethylene oxide can also be used as starting materials. The sulfur atom of 4-chlorobenzyl mercaptan launches a nucleophilic attack on the epoxy ring of ethylene oxide, and the ring is opened to form the corresponding alcohol intermediate. Next, the alcohol intermediate and imidazole are dehydrated and cyclized in the presence of a dehydrating agent to form the target 1 - {2- [ (4-chlorobenzyl) thio] -2 - (2,4-dichlorophenyl) ethyl} -1H -imidazole. In this path, the choice of dehydrating agent and the maintenance of the anhydrous environment of the reaction system are the key points to ensure the smooth progress of the reaction.
Another way is to use 2- (2,4-dichlorophenyl) ethanol as the starting material, and first convert its hydroxyl group into a suitable leaving group, such as p-toluenesulfonate. After that, the nucleophilic substitution reaction occurs with 4-chlorobenzyl mercaptan to form the thioether structure. Finally, it is reacted with imidazole under suitable conditions to realize the construction of the imidazole ring. This method needs to pay attention to the activity of the leaving group and the inhibition of side reactions during the reaction process.
All synthesis methods have their own advantages and disadvantages. According to the actual situation, such as the availability of raw materials, the ease of control of reaction conditions, and the purity requirements of the product, the best synthesis strategy should be weighed to prepare this compound efficiently.
1- {2- [ (4-Chlorobenzyl) sulfanyl] -2- (2,4-dichlorophenyl) ethyl} -1H-imidazole What are the precautions during use?
1-% {2- [ (4-chlorobenzyl) thio] 2- (2,4-dichlorophenyl) ethyl} -1H -imidazole This substance, when using, many things need to be paid attention to.
First, it is related to safety. This substance may be toxic, and safety procedures must be strictly followed when operating. Appropriate protective equipment is required, such as gloves and goggles, to prevent skin contact and eye contamination. If accidentally touched, rinse with plenty of water immediately and seek medical attention according to the actual situation.
Second, when it comes to storage. It should be placed in a cool, dry and well ventilated place, away from fire and heat sources. It needs to be stored separately from oxidants, acids, etc., and must not be mixed to prevent dangerous chemical reactions.
Third, it is related to the use environment. Operate in a fume hood to ensure air circulation and prevent its volatile gases from accumulating in the environment, endangering human health.
Fourth, the dosage should be precisely controlled. Due to its special role or nature, excessive use may cause adverse consequences or affect the expected effect. Therefore, it should be accurately measured and used according to specific uses and relevant standards.
Fifth, during experimental operation, the reaction conditions should be carefully regulated. Factors such as temperature, pH and other factors may affect the reaction process and products. It is necessary to strictly control the conditions according to the reaction characteristics to ensure the reliability and stability of the experimental results.