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What is the chemical structure of (1S) -3, 4-Dihydro-1-phenyl-2 (1H) -isoquinolinecarboxylic Acid (3R) -1-Azabicyclo- [2.2.2] oct-3-yl Ester Hydrochloride?
(The chemical structure of this compound is): The substance is named (1S) -3,4-dihydro-1-phenyl-2 (1H) -isoquinoline carboxylic acid (3R) -1 -azabicyclic [2.2.2] octyl-3 -yl ester hydrochloride.
Looking at its name, it can be seen that this is an organic compound. In its structure, (1S) and (3R) indicate the configuration of the chiral center. First, the 1-phenyl-2 (1H) -isoquinoline carboxylic acid part, isoquinoline is a nitrogen-containing heterocyclic ring and has aromatic properties. At 2 (1H), hydrogen atoms can participate in the reaction; 1-phenyl is attached to the isoquinoline ring, and the conjugated structure of the benzene ring affects the molecular properties. 3,4-dihydro indicates the hydrogenation and reduction of the 3,4-position double bonds of the isoquinoline ring.
Looking at the (3R) -1 -azabicyclo [2.2.2] octyl-3-yl ester part, 1-azabicyclo [2.2.2] octane is a cage-like structure with strong rigidity, and the 3-position is connected to the isoquinoline carboxylic acid into an ester bond. In this structure, the groups at both ends of the ester bond interact, which affects the overall stability and reactivity.
The final form of hydrochloride is a compound that forms a salt of hydrochloric acid to increase its solubility and stability in water. This structure endows the compound with unique physicochemical properties and may have important uses in organic synthesis, medicinal chemistry and other fields.
What are the main uses of (1S) -3,4-Dihydro-1-phenyl-2 (1H) -isoquinolinecarboxylic Acid (3R) -1-Azabicyclo- [2.2.2] oct-3-yl Ester Hydrochloride?
(1S) -3,4-dihydro-1-phenyl-2 (1H) -isoquinoline carboxylic acid (3R) -1-azabicyclic [2.2.2] octyl-3-yl ester hydrochloride, which has a wide range of uses. In the development of medicine, it can be used as a key intermediate to help develop many new drugs. In the field of neurological disorders, it may be able to create specific therapies for related diseases to relieve the suffering of patients. In the field of organic synthesis, with its unique chemical structure, it is often the cornerstone of the synthesis of complex organic compounds, assisting chemists to construct delicate molecular structures and expand the boundaries of organic synthesis. In the field of materials science, it may also emerge and contribute to the development of new materials with special properties, such as improving the stability and conductivity of materials, so as to promote the progress of materials science. In short, this compound has potential value in many important fields and offers many possibilities for scientific research and industrial development.
What are the synthesis methods of (1S) -3, 4-Dihydro-1-phenyl-2 (1H) -isoquinolinecarboxylic Acid (3R) -1-Azabicyclo- [2.2.2] oct-3-yl Ester Hydrochloride?
There are many ways to synthesize (1S) -3,4-dihydro-1-phenyl-2 (1H) -isoquinoline carboxylic acid (3R) -1-azabicyclo [2.2.2] octyl-3-yl ester hydrochloride.
To synthesize this compound, the choice of starting materials is extremely critical. The common method is to use specific phenyl isoquinoline derivatives and azabicyclo-octanol compounds as starting materials. First, the phenyl isoquinoline derivative is suitably modified to expose its active check point. This modification step, either by acid or base catalysis, or by applying specific chemical reaction conditions, makes its structure change for subsequent reaction with azabicyclic octanol compounds.
After the phenylisoquinoline derivative is modified, it is mixed with (3R) -1 -azabicyclic [2.2.2] octanol in a suitable reaction solvent. Commonly used reaction solvents, such as dichloromethane, N, N -dimethylformamide, etc., need to be carefully selected according to the specific needs of the reaction. At the same time, an appropriate amount of catalyst, such as an organic base or a metal catalyst, is added to accelerate the reaction process and promote the esterification reaction of the two to form the target product precursor. < Br >
Then the precursor is formed, which is not the final desired form of hydrochloride. At this time, the precursor product needs to be reacted with hydrogen chloride gas or hydrochloric acid solution under low temperature and stirring conditions. This reaction process must precisely control the reaction temperature and time. If the temperature is too high or the time is too long, it may lead to the decomposition of the product or produce side reactions. After the reaction is complete, a series of post-treatment steps such as extraction, washing, drying, and column chromatography can be used to obtain pure (1S) -3,4-dihydro-1-phenyl-2 (1H) -isoquinoline carboxylic acid (3R) -1-azabicyclo [2.2.2] octyl-3-yl ester hydrochloride. < Br >
Synthesis of this compound requires careful attention at every step and precise control of the reaction conditions in order to obtain the ideal product yield and purity.
What are the physicochemical properties of (1S) -3, 4-Dihydro-1-phenyl-2 (1H) -isoquinolinecarboxylic Acid (3R) -1-Azabicyclo- [2.2.2] oct-3-yl Ester Hydrochloride?
(1S) -3,4 -dihydro-1 -phenyl-2 (1H) -isoquinoline carboxylic acid (3R) -1 -azabicyclic [2.2.2] octyl-3 -yl ester hydrochloride, this is an organic compound. Its physical and chemical properties are quite important, let me tell you in detail.
Looking at its properties, it is usually white to quasi-white crystalline powder. This compound has a specific melting point, but the exact value needs to be determined experimentally and accurately, because different preparation methods and purity or melting point vary.
Solubility is also a key property. In common organic solvents, its solubility varies. In polar organic solvents such as methanol and ethanol, it may have a certain solubility, because some groups in the molecular structure can form hydrogen bonds with alcohol solvents and other interactions; while in non-polar organic solvents such as n-hexane, the solubility may be lower, because its molecular polarity is relatively large, and the force between it and the non-polar solvent is weak.
The chemical stability of the compound is also worthy of attention. Under normal temperature and pressure, dry environment, or have certain stability. In case of high temperature, high humidity or specific chemical reagents, or chemical reactions occur. The ester groups existing in the molecule, in case of acid or alkali conditions, or hydrolysis reactions occur, cause molecular structure changes. The azabicyclo and isoquinoline structure parts may also participate in various chemical reactions, such as reacting with electrophilic reagents and nucleophiles.
In addition, its optical activity is also an important property. Due to the existence of chiral centers in the molecule, it has optical activity, and different configurations may have significant effects on its biological activity and physicochemical properties.
The above description of the physicochemical properties of (1S) -3,4-dihydro-1-phenyl-2 (1H) -isoquinoline carboxylic acid (3R) -1 -azabicyclo [2.2.2] octyl-3 -yl ester hydrochloride is based on the properties of common organic compounds and the characteristics of similar structural compounds. The actual properties still need to be verified experimentally.
(1S) -3, 4-Dihydro-1-phenyl-2 (1H) -isoquinolinecarboxylic Acid (3R) -1-Azabicyclo- [2.2.2] oct-3-yl Ester Hydrochloride What are the precautions during use?
(1S) - 3,4 - dihydro - 1 - phenyl - 2 (1H) - isoquinoline carboxylic acid (3R) - 1 - azabicyclo [2.2.2] octyl - 3 - yl ester hydrochloride This substance, on the occasion of administration, many matters need to be considered.
The first weight is safe, and this medicine may have specific toxic and side effects. The user must read the drug manual carefully to know the possible adverse reactions, such as whether there is any allergy, whether the skin is rash, itching, and whether the breathing is rapid; also pay attention to the impact on the function of the viscera, and see if there is any gastrointestinal discomfort, such as nausea, vomiting, abdominal pain, diarrhea, or abnormal liver and kidney indicators. If there is a suspected adverse reaction, stop the drug immediately and seek medical attention immediately.
Times and usage and dosage must not be changed without authorization. It must be taken according to the doctor's instructions, in accordance with the amount on time. Or due to the severity of the disease, the patient's age, and constitution, the dosage varies. If used too little, it is difficult to achieve the therapeutic effect; if used too much, the risk of adverse reactions will increase.
Furthermore, during the medication period, the diet should also be cautious. Some foods may interact with the drug to affect the efficacy of the drug. Such as drinking alcohol, or interfering with the metabolism of the drug, resulting in reduced efficacy and increased burden on the liver; eating foods rich in specific ingredients, or chemical reactions with the drug. Therefore, it is advisable to consult a doctor or pharmacist to know the dietary taboos.
At the same time, it is especially prudent to use it in combination with other drugs. There are interactions between many drugs, or to enhance the efficacy of the drug to increase toxicity, or to weaken the efficacy of the drug to cause illness that is difficult to control. If other drugs are being used, be sure to inform the doctor, so that the doctor can weigh the pros and cons and decide on an appropriate medication plan.
In addition, proper storage should not be ignored. Store according to the conditions specified in the instructions, such as temperature, humidity, light and other requirements. If stored improperly, the drug may deteriorate, lose its efficacy, and even produce harmful substances. So all, when using this drug, it is recommended to use it with caution to ensure the safety and effectiveness of the drug.