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What is the chemical structure of N- [2- [[[4- (Aminoiminomethyl) phenyl] amino] methyl] -1-Methyl-1H-Benzimidazol-5-Yl] Carbonyl] -N-2-Pyridinyl-Beta-Alanine Ethyl Ester 4-Methylbenzenesulfonate?
This is a complex organic compound with a long name and chemical expertise. To understand its chemical structure, it is necessary to dissect and analyze it according to the naming rules of organic chemistry.
First view "N - [2 - [[4 - (Aminoiminomethyl) phenyl] amino] methyl] - 1 - Methyl - 1H - Benzimidazol - 5 - Yl] Carbonyl] - N - 2 - Pyridinyl - Beta - Alanine Ethyl Ester 4 - Methylbenzenesulfonate". Among them, the "N - [2 - [[4 - (Aminoiminomethyl) phenyl] amino] methyl] - 1 - Methyl - 1H - Benzimidazol - 5 - Yl] Carbonyl]" part indicates the presence of a benzimidazole ring as the core structure. The 1st position has methyl substitution, and the 5th position is connected by a carbonyl group to a complex side chain, which contains methylene, which is in turn connected to a phenyl ring containing an aminoamidine group. The phenyl ring has an aminoamidine group at the 4th position.
"N-2 - Pyridinyl - Beta - Alanine Ethyl Ester" revealed that the part connected to the above structure is β-alanine ethyl ester, and the nitrogen atom is connected with pyridine-2 - group.
"4 - Methylbenzenesulfonate", it can be known that the compound also exists p-methylbenzenesulfonate, which usually exists as a counterion.
In summary, this compound consists of benzimidazole ring, complex side chain, β-alanine ethyl ester structural unit and p-methylbenzenesulfonate. Its chemical structure is delicate and complex, and its various parts are interconnected. It may have specific chemical and biological characteristics in the field of organic chemistry.
What are the physical properties of N- [2- [[[4- (Aminoiminomethyl) phenyl] amino] methyl] -1-Methyl-1H-Benzimidazol-5-Yl] Carbonyl] -N-2-Pyridinyl-Beta-Alanine Ethyl Ester 4-Methylbenzenesulfonate?
This substance is called N - [2 - [[4 - (aminoiminomethyl) phenyl] amino] methyl] - 1 - methyl - 1H - benzimidazole - 5 - yl] carbonyl - N - 2 - pyridyl - β - alanine ethyl ester 4 - methylbenzene sulfonate. Its physical properties are described in the following ancient proverbs:
This compound is often in a solid state, and its shape is apparent. It is either crystalline, uniform and has a regular geometric shape, or powder, fine as dust, and scattered. Its color is either plain white like snow, pure and flawless; or slightly yellowish, like the first light of morning, with warm light looming.
As for its melting point, under specific conditions, it gradually melts when heated. The temperature of this transformation is quite critical, which is one of its characteristics. However, the specific value needs to be determined by precise experimental measurement, scientific instruments, and rigorous steps.
Solubility is also an important physical property. In water, or slightly soluble, only a little can be dissolved in clear waves, making water slightly more qualitative; or insoluble, such as stone sinking abyss, difficult to mix with water. And in organic solvents, such as ethanol, acetone, etc., the state of dissolution varies. In ethanol, or an appropriate amount of solubility, so that the liquid is clear and has a slight smell of matter; in acetone, or the solubility is slightly different, or the speed is different, all need to be investigated in detail by experiment.
Its density is also important to consider. Although invisible and palpable, between the measurement and trade-off, it can be known that the mass content per unit volume is geometric, compared with common things, or lighter than feathers, or heavier than stones, which are all related to its internal structure and composition.
The above physical properties are all speculative theories. To obtain accurate and detailed data, we must use modern scientific experiments as the basis and carefully measure the details to obtain its true meaning.
What are the common uses of N- [2- [[[4- (Aminoiminomethyl) phenyl] amino] methyl] -1-Methyl-1H-Benzimidazol-5-Yl] Carbonyl] -N-2-Pyridinyl-Beta-Alanine Ethyl Ester 4-Methylbenzenesulfonate?
This is an organic compound with a long and complicated name. In practical applications, common uses or paths are mostly related to drug development. Due to its unique structure or specific biological activity, the compound can become a key intermediate for drug creation.
In the field of pharmaceutical chemistry, it is often used as a starting material, and its structure is carefully modified through multi-step chemical reactions, aiming to obtain new drugs with ideal pharmacological properties. This process requires chemists to skillfully manipulate the reaction conditions with exquisite skills and profound knowledge to achieve efficient synthesis of the target product.
In addition, in the study of biological activity, the interaction between this compound and biological macromolecules (such as proteins, nucleic acids, etc.) will also be deeply explored. Through advanced experimental techniques, its mechanism of action can be clarified to provide a solid theoretical basis for the development of new drugs. It may be used to screen potential drug targets and help develop innovative therapies for specific diseases.
Furthermore, in the process of drug development, the physical and chemical properties of the compound, such as solubility and stability, need to be considered in order to design an appropriate dosage form to ensure the effective delivery and release of the drug in the body, thereby enhancing the efficacy and safety of the drug. In short, although its name is obscure, it may play an indispensable role in the whole process of drug development.
What are the synthesis methods of N- [2- [[[4- (Aminoiminomethyl) phenyl] amino] methyl] -1-Methyl-1H-Benzimidazol-5-Yl] Carbonyl] -N-2-Pyridinyl-Beta-Alanine Ethyl Ester 4-Methylbenzenesulfonate?
To prepare N - [2 - [[4 - (aminomethyl) phenyl] amino] methyl] - 1 - methyl - 1H - benzimidazole - 5 - yl] carbonyl - N - 2 - pyridyl - β - alanine ethyl ester 4 - methylbenzene sulfonate, the synthesis method is quite complicated.
The key intermediate needs to be prepared first. With suitable starting materials, the structure of benzimidazole is constructed through multi-step reaction. For example, a compound containing a benzene ring can be selected first, an amino group can be introduced through nitrification, reduction, etc., and then condensed with a suitable aldehyde or ketone to form an imidazole ring. At the same time, methylation and other modifications can be carried out to obtain a benzimidazole derivative containing a specific substituent.
For the pyridine moiety, it is also necessary to start from the corresponding pyridine compound and go through a substitution reaction to make the pyridine ring connect to a suitable functional group for subsequent connection with the benzimidazole moiety.
The beta-alanine ethyl ester moiety can be prepared by reacting ethyl acrylate with ammonia or amine compounds, and then its amino group is protected or modified to meet the needs of subsequent reactions.
After the key intermediates are prepared, benzimidazole derivatives, pyridine derivatives and β-alanine ethyl ester are partially connected by condensation reaction to form the precursor of the target compound.
Finally, the precursor is reacted with 4 - methylbenzenesulfonic acid to form a salt to give N - [2 - [[4 - (aminoiminomethyl) phenyl] amino] methyl] - 1 - methyl - 1H - benzimidazole - 5 - yl] carbonyl - N - 2 - pyridyl - β - alanine ethyl ester 4 - methylbenzene sulfonate. Each step of the reaction requires fine control of the reaction conditions, such as temperature, pH, and the proportion of reactants, and each step requires separation and purification to ensure the purity and yield of the product.
N- [2- [[[4- (Aminoiminomethyl) phenyl] amino] methyl] -1-Methyl-1H-Benzimidazol-5-Yl] Carbonyl] -N-2-Pyridinyl-Beta-Alanine Ethyl Ester 4-Methylbenzenesulfonate What are the precautions during use?
This is a rather complex chemical called N - [2 - [[4 - (aminomethyl) phenyl] amino] methyl] - 1 - methyl - 1H - benzimidazole - 5 - yl] carbonyl - N - 2 - pyridyl - β - alanine ethyl ester 4 - methylbenzene sulfonate. When using, many things need to be careful.
Bearing the brunt, this substance has potential chemical activity. When in contact, you must wear suitable protective equipment, such as gloves, goggles, lab clothes, etc., to prevent it from directly touching the skin and eyes and avoid irritation or damage. Due to its special chemical structure, or certain toxicity and biological activity, the operation process must not be eaten, smoked, or ingested orally.
Furthermore, storage should not be ignored. It should be stored in a dry, cool and well-ventilated place, away from fire, heat and strong oxidants to prevent fire, explosion and other hazards. And it should be strictly sealed to avoid moisture or reaction with air components, causing it to deteriorate.
During use, accurate weighing and operation are key. Due to its sensitive chemical properties, the dosage is slightly deviated, or the experimental results are very different, it is necessary to follow the precise experimental procedures. If solution preparation is involved, the solvent selection, concentration calculation, etc. must be extremely accurate.
In addition, after use, the disposal of remaining substances and waste should not be underestimated. It should not be discarded at will. It should follow the relevant chemical waste treatment regulations, be sorted, collected and properly disposed of to avoid pollution to the environment.
In short, when using this chemical substance, it is necessary to maintain a high degree of caution at all times, and strictly follow the operating procedures and safety guidelines to ensure personal safety and smooth experimentation.