2 4 Nitrobenzyl Sulfanyl 1h Benzimidazole
quinoline thiophene imidazole thiazole

2-[(4-nitrobenzyl)sulfanyl]-1H-benzimidazole

    Specifications

    HS Code

    348327

    Chemical Formula C14H11N3O2S
    Molecular Weight 285.325 g/mol
    Appearance Typically a solid, color might vary depending on purity
    Physical State At Room Temperature Solid
    Melting Point Data may vary, needs experimental determination
    Boiling Point Data may vary, needs experimental determination
    Solubility In Water Expected to be low due to non - polar nature of benzimidazole and nitrobenzyl moieties
    Solubility In Organic Solvents Likely soluble in common organic solvents like DMSO, chloroform
    Pka Values related to benzimidazole ring can influence acidity, data needs experimental determination
    Logp Positive value expected due to non - polar groups, related to lipophilicity

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    Frequently Asked Questions

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    What is the chemical structure of 2- [ (4-nitrobenzyl) sulfanyl] -1H-benzimidazole
    2-% 5B% 284 - nitrobenzyl%29sulfanyl%5D - 1H - benzimidazole is an organic compound. Its chemical structure is as follows:
    The core of this compound is a benzimidazole ring, which is formed by fusing a benzene ring with an imidazole ring. The benzimidazole ring is quite common in many drugs and bioactive molecules, and has unique electronic properties and bioactive potential.
    At position 2 of the benzimidazole ring, there is a substituent. This substituent is (4-nitrobenzyl) thio. Among them, the benzyl group is composed of a benzene ring linked to methylene (-CH 2O -). Nitro is a strong electron-absorbing group, which can significantly affect the electron cloud distribution, chemical activity and physical properties of compounds. Sulfur atoms (-S-) connect benzyl to benzimidazole ring, and the presence of sulfur atoms also affects the reactivity and intermolecular forces of compounds.
    In summary, the chemical structure of 2-% 5B% 284-nitrobenzyl%29sulfanyl%5D-1H-benzimidazole gives it unique chemical and physical properties through the combination of benzimidazole ring and (4-nitrobenzyl) sulfur group, which may have important research value and potential applications in organic synthesis, medicinal chemistry and other fields.
    What are the physical properties of 2- [ (4-nitrobenzyl) sulfanyl] -1H-benzimidazole
    2 - [ (4 -nitrobenzyl) thioalkyl] -1H -benzimidazole is one of the organic compounds. Its physical properties are quite important and are related to many applications of this compound.
    Looking at its properties, it mostly shows a solid state under normal conditions, which is caused by intermolecular forces. In the molecular structure, the benzimidazole ring interacts with the nitrobenzyl thioalkyl group-containing part, resulting in an orderly arrangement of molecules and a tendency to form a solid state.
    The melting point has been determined by many experiments and is about a specific temperature range. The value of this melting point is affected by factors such as intermolecular hydrogen bonds and van der Waals forces. The conjugated structure of the benzimidazole ring and the strong electron-absorbing properties of the nitro group all contribute to the intermolecular forces, which in turn affect the melting point.
    In terms of solubility, the compound exhibits certain solubility properties in organic solvents, such as some common alcohols and ethers. Because the molecule has a certain polarity, it can interact with organic solvents through intermolecular forces, such as dipole-dipole interaction. However, the solubility in water is not good, because its molecular hydrophobic part accounts for a large proportion, and its ability to form hydrogen bonds with water molecules is limited.
    Furthermore, its appearance is often white to light yellow powder, and the formation of this color is related to the intramolecular electron transition and absorption spectrum. The benzimidazole ring and nitro structure, which absorb and reflect light at specific wavelengths, exhibit such color characteristics.
    In summary, the physical properties of 2 - [ (4-nitrobenzyl) thialkyl] -1H -benzimidazole, such as state, melting point, solubility, appearance, etc., are determined by its unique molecular structure, and play a key role in applications in many fields such as chemical industry and medicine.
    What are the synthesis methods of 2- [ (4-nitrobenzyl) sulfanyl] -1H-benzimidazole
    To prepare 2 - [ (4 - nitrobenzyl) thio] -1H - benzimidazole, there are many methods, and each has its own advantages and disadvantages. The following are common synthesis methods:
    First, using o-phenylenediamine and 4 - nitrobenzyl mercaptan as raw materials, obtained by condensation reaction. Put o-phenylenediamine and 4 - nitrobenzyl mercaptan in an appropriate proportion in a suitable solvent, such as ethanol, dichloromethane, etc., add an appropriate amount of catalyst, such as p-toluenesulfonic acid, and stir the reaction at a certain temperature. The reaction conditions are relatively mild and the operation is relatively simple. However, it is necessary to pay attention to the control of the proportion of raw materials and the reaction temperature, otherwise it is easy to cause side reactions and affect the purity and yield of the product.
    Second, benzimidazole intermediates are prepared by reacting o-phenylenediamine with carboxylic acids, and then substitution reactions are carried out with 4-nitrobenzyl halide. First, the o-phenylenediamine is reacted with the corresponding carboxylic acid at high temperature to form a benzimidazole structure, and then the resulting intermediate is reacted with 4-nitrobenzyl halide, such as 4-nitrobenzyl chloride or 4-nitrobenzyl bromide, under basic conditions, such as potassium carbonate, sodium hydroxide, etc., in a suitable solvent. This approach has a little more steps, but it can better control the reaction process, and the purity of the product is relatively high. Only the multi-step reaction causes the overall yield to be affected.
    Third, the coupling reaction catalyzed by transition metals. With benzimidazole-containing halides and 4-nitrobenzyl mercaptan derivatives, the reaction is catalyzed by transition metal catalysts such as palladium and copper under the action of suitable ligands and bases. This method has the advantages of high efficiency and good selectivity, but the catalyst cost is high, the reaction equipment and operation requirements are also high, or its large-scale application is limited. < Br >
    When synthesizing 2- [ (4-nitrobenzyl) thio] -1H-benzimidazole, the appropriate synthesis method should be carefully selected according to actual needs, considering factors such as raw material cost, reaction conditions, product purity and yield.
    2- [ (4-nitrobenzyl) sulfanyl] -1H-benzimidazole is used in what fields
    2-% 5B% 284 - nitrobenzyl%29sulfanyl%5D - 1H - benzimidazole is a special organic compound. It has considerable applications in various fields.
    In the field of medicine, this compound shows unique potential. Or because of its structural properties, it can act on specific biological targets. For example, in the field of tumor research, it is expected to use its structure and activity to develop new anti-tumor drugs. It may interfere with key signaling pathways of tumor cells, block the proliferation and metastasis of tumor cells, and find new ways to solve cancer problems.
    In the field of materials science, 2-% 5B% 284 - nitrobenzyl%29sulfanyl%5D - 1H - benzimidazole also has its uses. Due to its specific electronic properties and chemical stability, it can be used to prepare functional materials. For example, it can be used to synthesize polymer materials with special optical or electrical properties, and can be applied to optoelectronic devices, such as Light Emitting Diodes, solar cells, etc., to improve the performance and efficiency of such devices.
    Furthermore, in the field of chemical research, it can be used as an important organic synthesis intermediate. With its special functional groups, it can participate in a variety of organic reactions to construct more complex organic molecular structures. Chemists can create compounds with novel structures and properties by modifying and derivatizing them, contributing to the development of organic chemistry.
    In short, 2-% 5B% 284 - nitrobenzyl%29sulfanyl%5D - 1H - benzimidazole has great application value and research potential in many fields such as medicine, materials science, chemical research, etc. It is a compound worthy of further investigation.
    What is the market outlook for 2- [ (4-nitrobenzyl) sulfanyl] -1H-benzimidazole?
    There are now 2 - [ (4 - nitrobenzyl) thio] -1H - benzimidazole, and its market prospect is related to many aspects.
    Looking at its properties, this compound has a unique structure and contains benzimidazole and nitrobenzyl thio moiety. Benzimidazole compounds often have various biological activities in the field of medicine, such as anti-cancer, antibacterial, antiviral, etc. The introduction of 4 - nitrobenzyl thio may endow it with different characteristics, which adds variables to its application.
    In the pharmaceutical market, with the increasing demand for conquering difficult diseases, compounds with unique structures and activities have attracted much attention. If this compound is studied in depth and can demonstrate a clear therapeutic effect, such as a significant inhibitory effect on specific cancers or viruses, its market potential is limitless. Pharmaceutical companies will compete to invest in research and development, and it is expected to be developed into innovative drugs and gain a place in the global pharmaceutical market.
    In the chemical industry, it may be used as an intermediate in organic synthesis. With its structural characteristics, it can participate in a series of chemical reactions to synthesize more complex compounds with special functions, providing new avenues for the development of fine chemical products, such as the preparation of new materials and special dyes, to meet the demand for special chemicals in high-end manufacturing.
    However, its market prospects also pose challenges. R & D costs are high, and it takes a huge amount of money and a long time to go from basic research to clinical trials to approval for marketing. And the market competition is fierce, and there are many similar bioactive compounds. To stand out, unique advantages are required. Furthermore, environmental protection requirements are becoming stricter, and if there are pollution problems in the production process, it may restrict its large-scale production and marketing activities.
    In short, if 2- [ (4-nitrobenzyl) thio] -1H -benzimidazole can effectively overcome the problems of research and development and production, and give full play to its structural advantages, it will shine in the pharmaceutical and chemical markets, and the prospects are promising.