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What is the chemical structure of 1- [2- (2,4-dichlorophenyl) -2- [[4- (phenylthio) phenyl] methoxy] ethyl] -1H-imidazole mononitrate?
1 - [2- (2,4-dihydroxyphenyl) -2- [[4- (phenyl) phenyl] ethoxy] ethyl] -1H-indole-3-carboxylic acid ketone is an organic compound with a complex chemical structure and is composed of many groups.
The core structure of this compound is a 1H-indole ring, which is connected to a large multi-branched substituent at 1 position. The substituent starts with an ethyl group, the No. 2 carbon on this ethyl group, which is connected to a phenyl group with 2,4-dihydroxy at one end and a diphenyl structure bridged by ethoxy at the other end. In this diphenyl structure, one phenyl group is attached to the oxygen atom of the ethoxy group, and the other phenyl group is attached to the 4th position of the phenyl group. The 3rd position of the indole ring is connected to a formate ketone group.
The chemical structure of this compound is endowed with unique chemical and physical properties through these specific atomic connection orders and spatial arrangements. Its complex structure may make it show specific reactivity and potential application value in organic synthesis, medicinal chemistry and other fields.
What are the main uses of 1- [2- (2,4-dichlorophenyl) -2- [[4- (phenylthio) phenyl] methoxy] ethyl] -1H-imidazole mononitrate?
1-%5B2-%282%2C4-%E4%BA%8C%E6%B0%AF%E8%8B%AF%E5%9F%BA%29-2-%5B%5B4-%28%E8%8B%AF%E7%A1%AB%E5%9F%BA%29%E8%8B%AF%E5%9F%BA%5D%E7%94%B2%E6%B0%A7%E5%9F%BA%5D%E4%B9%99%E5%9F%BA%5D-1H-%E5%92%AA%E5%94%91%E5%8D%95%E7%A1%9D%E9%85%B8%E7%9B%90%E7%9A%84%E5%85%B7%E4%BD%93%E5%88%86%E5%AD%90%E7%BB%93%E6%9E%84%E5%A4%A7%E6%96%B9%E5%90%91%E5%B7%B2%E7%9F%A5%E6%88%91%E4%BB%AC%E5%8F%AF%E7%94%A8%E4%BB%A5%E4%B8%8B%E8%AF%B4%E6%98%8E%E5%85%B6%E4%B8%BB%E8%A6%81%E7%94%A8%E9%80%94%EF%BC%9A
The name of this compound is, 1 - [2 - (2,4 - dichlorophenyl) - 2 - [[4 - (phenyl) phenyl] ethoxy] propyl] - 1H - imidazole carboxylic acid esters, wherein imidazole plays an important role in the biologically active molecules of polymers. Imidazole has the characteristics of rich particles, easy to react to various molecules, such as nuclear substitution, and can form new compounds. The introduction of different functionalities provides the possibility of integral compounds.
The presence of 2,4 - dichlorophenyl can increase the lipid solubility of compounds, making them easy to penetrate biological membranes. Due to the fact that biofilms are mainly composed of lipids, fat-soluble molecules are more easily accessible, which is important when the compound is transferred to the target cell or target cell, and can improve the bioavailability of the compound.
Ethoxy-bonded phenyl can increase the molecular properties and planarity, and affect the biological macromolecule interaction of the compound. For example, when the compound is subjected to a combination, the specific properties and planarity can better fit the active site, increase the synergy, and improve the potency of the compound.
This compound integrates the purpose or uses the characteristics of each part to give its specific biological activity. It may be used as a precursor or active ingredient in the domain, and the interaction of each group can be improved to target treatment, improve efficacy, and reduce side effects.
What are the physical properties of 1- [2- (2,4-dichlorophenyl) -2- [[4- (phenylthio) phenyl] methoxy] ethyl] -1H-imidazole mononitrate?
1 - [2 - (2,4 - dihydroxyphenyl) - 2 - [[4 - (phenyl) phenyl] ethoxy] ethyl] -1H - indole-3 - carboxylic acid methyl ester is an organic compound. Its physical properties are related to many external and internal properties of the substance, which is of great significance for its application in chemistry, medicine and other fields. The following is an ancient saying:
This compound has a specific melting point and boiling point. The melting point is the temperature at which the substance changes from solid to liquid. After experimental observation, its melting point is within a certain range, which can help to identify and purify the substance. When heated to this temperature range, the compound molecules are energized, the lattice structure gradually disintegrates, and then melts into a liquid state.
The boiling point is the temperature at which the liquid changes to the gaseous state. At this temperature, the boiling point of the compound is also fixed. At this temperature, the kinetic energy of the molecule is sufficient to overcome the attractive forces between molecules and escape from the liquid phase into the gas phase. By measuring its boiling point, its volatility and thermal stability can be understood. It plays a significant role in separation, purification and setting of reaction conditions.
Solubility is also an important physical property. It dissolves differently in different solvents. In organic solvents such as ethanol and acetone, it may have good solubility. Due to the formation of specific forces between the compound molecules and the solvent molecules, such as hydrogen bonds, van der Waals forces, etc., it can be dispersed in the solvent. In water, the solubility is poor, and the force between the structure of the compound and the water molecules is weak.
Density is the mass per unit volume. This compound has a specific density, which is related to its distribution and separation in the mixed system. If mixed with other substances, it can be separated by sedimentation, centrifugation, etc. according to the density difference.
The refractive index reflects the change of the propagation speed and direction of light in the compound. Its refractive index is a constant value, and this characteristic can be used to identify the purity and concentration of the compound. Due to the presence of impurities, the refractive index can be changed, so the measurement of refractive index can determine the purity of the compound.
What is the synthesis method of 1- [2- (2,4-dichlorophenyl) -2- [[4- (phenylthio) phenyl] methoxy] ethyl] -1H-imidazole mononitrate?
The synthesis of 1 - [2 - (2,4 - dioxybenzyl) - 2 - [[4 - (benzoyl) benzyl] acetoxy] ethyl] - 1H - indole-3 - carboxylic acid is a key issue in the field of organic synthesis. This compound may have important application potential in many fields such as medicinal chemistry, so it is of great significance to explore an efficient synthesis path.
To synthesize this compound, the following steps can be followed: First, the key intermediate can be prepared. With appropriate starting materials, the structural unit containing 2,4 - dioxybenzyl can be constructed by condensation reaction. For example, a specific phenolic compound is selected with a halogenated acetate, and under the catalysis of a base, a nucleophilic substitution reaction occurs to introduce 2,4-dioxy benzyl.
In the next step, for the introduction of 4- (benzoyl) benzyl, benzoyl chloride and the corresponding benzyl derivative can be carried out under the catalysis of Lewis acid to carry out a Fu-gram acylation reaction to generate a product containing 4- (benzoyl) benzyl. Then, this product is combined with the intermediate containing 2,4-dioxy benzyl obtained in the previous step, and an acetoxy group is introduced through an esterification reaction. In this process, it is necessary to precisely control the reaction conditions, such as temperature, reaction time, and molar ratio of the reactants, to ensure the high efficiency and selectivity of the reaction.
In addition, when constructing the indole ring part, a classical synthesis method can be used, such as the Fisher indole synthesis method. Select suitable aryl hydrazine and an aldehyde or ketone with appropriate substituents, and under the action of an acidic catalyst, cyclize to form an indole ring structure. This step also requires careful regulation of the reaction parameters to prevent side reactions.
At the end of the step, the resulting product is subsequently modified and purified. The purity of the product was improved by column chromatography, recrystallization and other means, and the final target product was obtained 1 - [2 - (2,4-dioxybenzyl) - 2 - [[4 - (benzoyl) benzyl] acetoxy] ethyl] -1H -indole-3 -carboxylic acid. The whole process of synthesis needs to be closely monitored. The structure and purity of each step of the product are confirmed by thin layer chromatography, nuclear magnetic resonance and other analytical techniques to ensure the feasibility and reliability of the synthesis route.
What are the safety precautions for 1- [2- (2,4-dichlorophenyl) -2- [[4- (phenylthio) phenyl] methoxy] ethyl] -1H-imidazole mononitrate?
1-% 5B2-% 282,4-Dihydroxyphenyl% 29-2-% 5B% 5B4-% 28 silyl% 29 phenyl% 5D ethoxy% 5D isopropyl-1H-imidazole monocarboxylic anhydride, its safety should be paid attention to.
This compound is used in medicine, chemical industry and other fields, but its chemical structure is complex, and it is the first toxicity when used. When the data of animal experiments and human clinical trials are carefully examined to clarify its acute and chronic toxicity. Looking at its impact on the function and growth of experimental animal organs, if there is a risk of teratogenicity, carcinogenicity and mutation, it should not be used lightly.
Furthermore, its allergenicity should not be ignored. When in contact with the skin or mucous membranes, it is necessary to check for allergic reactions. Use a small amount of animal skin to observe whether it has redness, swelling, itching, rash, etc.; in human clinical trials, it is also necessary to pay attention to whether the subject has allergic manifestations.
Stability is also key. This anhydride may decompose and deteriorate under different temperature, humidity, and light conditions. High temperature, high humidity, or strong light exposure may cause its structure to change, lose its activity, or even produce harmful impurities. Therefore, when storing, it must choose the appropriate temperature, humidity, and light environment according to its characteristics.
In addition, its compatibility with other substances also needs to be carefully investigated. During the preparation process, it is mixed with excipients and other active ingredients, or interacts. It may change the solubility, or cause chemical reactions to occur, affecting product quality and efficacy. Therefore, when developing preparations, it is necessary to comprehensively investigate their compatibility characteristics.
All of these are 1-% 5B2-% 282,4-dihydroxyphenyl% 29-2-% 5B% 5B4-% 28 silyl% 29 phenyl% 5D ethoxy% 5D isopropyl-1H-imidazole monocarboxylic anhydride. In the use, storage, research and development, important precautions related to safety must not be taken lightly.