1 Azabicyclo 2 2 2 Octan 3 Yl 1 Phenyl 3 4 Dihydro 1h Isoquinoline 2 Carboxylate
quinoline thiophene imidazole thiazole

1-azabicyclo[2.2.2]octan-3-yl 1-phenyl-3,4-dihydro-1h-isoquinoline-2-carboxylate

Taiy Chemical

    Specifications

    HS Code

    483147

    Chemical Formula C26H30N2O2
    Molecular Weight 398.53 g/mol
    Physical State Solid (usually)
    Appearance White to off - white powder
    Melting Point Specific value would require experimental determination
    Solubility In Water Low solubility, likely insoluble
    Solubility In Organic Solvents Soluble in common organic solvents like dichloromethane, chloroform
    Pka No common pKa values readily available as it is a non - acidic/basic structure in common sense
    Logp Expected to be relatively high, indicating lipophilic nature

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    Frequently Asked Questions

    As a leading 1-azabicyclo[2.2.2]octan-3-yl 1-phenyl-3,4-dihydro-1h-isoquinoline-2-carboxylate supplier, we deliver high-quality products across diverse grades to meet evolving needs, empowering global customers with safe, efficient, and compliant chemical solutions.

    1-Azabicyclo [2.2.2] octan-3-yl 1-phenyl-3, what is the chemical structure of 4-dihydro-1H-isoquinoline-2-carboxylate
    1 - azabicyclo [2.2.2] octan - 3 - yl 1 - phenyl - 3,4 - dihydro - 1H - isoquinoline - 2 - carboxylate, this is the name of an organic compound. According to the ancient classical text of "Tiangong Kaiwu", its chemical structure can be described as follows:
    Looking at this compound, its structure is complex and delicate, just like the work of heaven. The nitrogen-containing heterocyclic part is named after 1 - azabicyclo [2.2.2] octan - 3 - yl. If this heterocyclic ring is interlocked, it is like an ancient chain. The rings are closely connected by chemical bonds, and there are two rings in total. Each ring is constructed from a specific number of atoms. The nitrogen atom is located in a specific position in one ring, like a pearl embedded in the ring, adding unique chemical activity to the whole structure.
    And the 1-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxylate part is also interesting. 1-phenyl, a phenyl group, is like a fragrant flower attached to the main structure. 3,4-Dihydro-1H-isoquinoline is a unique fused ring system. Although it is modified by dihydrogen, its interring conjugated system still has different chemical properties. At 2-carboxylate, it seems to be a special functional group, such as the special identification tied to the fused ring, which endows the whole molecule with specific chemical properties and reactivity.
    This compound is a whole, its parts complement each other, and its structure is exquisite. It is just like a natural creation, showing the wonders of the chemical microscopic world. The atoms and groups are maintained by chemical bonds to form a unique and stable chemical entity, which has unique research value and potential applications in the field of organic chemistry.
    1-Azabicyclo [2.2.2] octan-3-yl 1-phenyl-3, what are the physical properties of 4-dihydro-1H-isoquinoline-2-carboxylate
    1 - azabicyclo [2.2.2] octan - 3 - yl 1 - phenyl - 3,4 - dihydro - 1H - isoquinoline - 2 - carboxylate is an organic compound. Its physical properties are very important, and it is related to the characteristics and applications of this compound in various scenarios.
    First, the appearance of this compound is usually white to quasi-white crystalline powder. This form is easy to observe and distinguish. In the process of material identification and quality control, appearance is the primary consideration. Powder is conducive to subsequent processing, and operations such as dissolution and mixing are more convenient.
    Let's talk about the melting point, which is in a specific range. The melting point is an inherent property of a substance, which is of great significance for the determination of the purity of a compound. If the purity is high, the melting point range is relatively narrow and close to the theoretical value; if it contains impurities, the melting point decreases and the range becomes wider. By measuring the melting point, the purity status of the compound can be evaluated.
    The solubility of the compound cannot be ignored. In organic solvents such as ethanol and dichloromethane, it exhibits a certain solubility. This property is widely used in the field of organic synthesis and can be used to screen reaction solvents, making the reaction more likely to occur. However, the solubility in water is poor, which limits its application in aqueous systems, but also facilitates separation from the aqueous phase.
    In addition, the density of the compound has a specific value. Density has a great influence on its distribution in the mixture and related process design. For example, when it involves delamination, centrifugation, etc., density is a key parameter.
    Finally, the stability of this compound is good in normal temperature and pressure, dry environment. However, if exposed to high temperature, high humidity or strong light environment, degradation or deterioration may occur. Therefore, when storing and transporting, it is necessary to pay attention to environmental conditions to maintain the stability of its chemical structure and properties. In short, these physical properties are of important guiding value for the research, production and application of this compound.
    1-Azabicyclo [2.2.2] octan-3-yl 1-phenyl-3, what is the main use of 4-dihydro-1H-isoquinoline-2-carboxylate
    1 - azabicyclo [2.2.2] octan - 3 - yl 1 - phenyl - 3,4 - dihydro - 1H - isoquinoline - 2 - carboxylate is an organic compound. Its main use is related to the field of medicinal chemistry.
    In pharmaceutical research and development, such compounds often exhibit unique biological activities. Or because their structures contain specific rings and functional groups, they can interact with specific targets in organisms. Such as binding to certain receptors, enzymes, etc., to regulate physiological processes. It may have potential value in the study of neurological-related diseases, or can affect the transmission of neurotransmitters and the activity of nerve cells, etc., and is expected to provide novel drug lead compounds for the treatment of epilepsy, Parkinson's disease and other neurological diseases.
    Furthermore, in the exploration of the structure-activity relationship of pharmaceutical chemistry, this compound can be used as a key research object. Chemists explore the effect of structural changes on biological activities by modifying its structure, such as changing the substituents on the benzene ring and adjusting the characteristics of the double ring structure, in order to optimize the therapeutic effect of the compound, reduce toxic and side effects, and lay the foundation for the creation of safer and more effective drugs.
    In the field of organic synthetic chemistry, the synthesis method of this compound has also attracted attention. Its complex structure challenges the skills of synthetic chemists, prompts the development of new synthetic strategies and methods, promotes the progress of organic synthetic chemistry, and provides reference and ideas for the construction of more complex and functional organic molecules.
    1-Azabicyclo [2.2.2] octan-3-yl 1-phenyl-3, what are the synthesis methods of 4-dihydro-1H-isoquinoline-2-carboxylate
    1 - azabicyclo [2.2.2] octan - 3 - yl 1 - phenyl - 3,4 - dihydro - 1H - isoquinoline - 2 - carboxylate (1 - azabicyclo [2.2.2] octane - 3 - yl 1 - phenyl - 3,4 - dihydro - 1H - isoquinoline - 2 - carboxylate) synthesis method, covering a variety of routes.
    First, 1-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxylic acid can be used to react with 1-azabicyclic [2.2.2] octane-3-alcohol in the presence of a condensing agent such as dicyclohexyl carbodiimide (DCC) or 1-ethyl-3- (3-dimethylaminopropyl) carbodiimide hydrochloride (EDC · HCl) in suitable organic solvents such as dichloromethane and N, N-dimethylformamide (DMF). This reaction needs to be controlled at a certain temperature range, usually starting at low temperature and gradually rising to room temperature or slightly higher temperature, so that the esterification reaction of the two occurs to form the target product. Pay attention to the amount of condensing agent during the reaction, too much or too little may affect the reaction yield.
    Second, 1-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxylic acid can also be activated first, such as by converting it into the corresponding acid chloride. The carboxylic acid can react with reagents such as oxalyl chloride or dichlorosulfoxide in the presence of N, N-dimethylformamide to form an acid chloride. Afterwards, the acid chloride is reacted with 1-azabicyclo [2.2.2] octane-3-ol in an organic solvent in the presence of bases such as triethylamine, pyridine, etc. The role of the base is to neutralize the hydrogen chloride generated by the reaction and promote the reaction forward.
    Third, the coupling reaction strategy catalyzed by transition metals can also be used. If a suitable palladium catalyst is selected, the 1-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxylic acid derivative is coupled with 1-azabicyclic [2.2.2] octane-3-based halides or similar active intermediates under suitable reaction conditions. This method requires stricter reaction conditions, and precise control of catalyst, ligand, base dosage, reaction temperature, time and other factors is required to obtain ideal yields and selectivity.
    What is the safety of 1-azabicyclo [2.2.2] octan-3-yl 1-phenyl-3, 4-dihydro-1H-isoquinoline-2-carboxylate
    1 - azabicyclo [2.2.2] octan - 3 - yl 1 - phenyl - 3,4 - dihydro - 1H - isoquinoline - 2 - carboxylate is an organic compound. The safety of this substance needs to be examined in detail from many aspects.
    Looking at its chemical structure, this compound is formed by the fusion of specific heterocyclic and aromatic ring structures. Unique structure or cause it to have specific physical and chemical properties. In terms of chemical activity, the bonds and functional groups contained in its structure may participate in various chemical reactions. If it is operated under unsuitable conditions, in case of hot topic, open flame or strong oxidant, or causing violent reaction, it is related to its thermal stability and chemical stability. Special attention should be paid during operation to prevent disasters such as explosion and fire.
    Re-discuss biological safety. Because the structure contains complex organic parts, it may have diverse effects on organisms. Or it has certain biological activity and can interact with biological macromolecules in organisms, such as proteins and nucleic acids. However, this interaction may be beneficial or harmful. For example, it may be used as a drug lead compound, modified and optimized for disease treatment; but it may also have toxic effects on organisms, such as damaging cells and interfering with normal physiological metabolic pathways. If accidentally ingested, inhaled or exposed to the skin, or causes poisoning symptoms, it poses a serious threat to human health.
    In terms of environmental safety, if this compound is released into the environment, its behavior in environmental media should not be underestimated. Due to its specific chemical structure, its degradation rate in soil, water, and atmosphere may be slow, and it is easy to accumulate in the environment. After accumulation, it may have toxic effects on environmental organisms, destroy the ecological balance, and affect the survival and reproduction of organisms at all levels of the food chain.
    In summary, the safety of 1 - azabicyclo [2.2.2] octan - 3 - yl 1 - phenyl - 3,4 - dihydro - 1H - isoquinoline - 2 - carboxylate is extremely complex. In the process of research and development, production and use, it is necessary to consider all kinds of latent risks and strictly follow safety regulations to ensure personnel safety and environmental safety.