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What is the chemical structure of (1S) -3, 4-dihydro-1-phenyl-2 (1H) -isoquinolinecarboxylic Acid (3R) -1-Oxido-1-azabicyclo [2.2.2] oct-3-yl Ester
This is the chemical name of (1S) -3,4-dihydro-1-phenyl-2 (1H) -isoquinoline carboxylic acid (3R) -1 -oxidized-1-azabicyclic [2.2.2] octyl-3-yl ester. To clarify its chemical structure, it should be analyzed by chemical knowledge.
Looking at this name, " (1S) -3,4-dihydro-1-phenyl-2 (1H) -isoquinoline carboxylic acid" part, it can be known that its isoquinoline-containing parent nuclear structure. Isoquinoline is a thick heterocyclic compound. In this structure, the 1-position is connected with a phenyl group, the 3 and 4 positions are dihydro states, and the 2-position is connected to a carboxyl group. Because of the (1S) label, the 1-position carbon has a specific three-dimensional configuration.
Then look at " (3R) -1 -oxidized-1-azabicyclo [2.2.2] octyl-3-yl ester", which reveals that it is an ester compound. 1-azabicyclo [2.2.2] octane is a bicyclic structure, the nitrogen atom is in the bridgehead position, the 1-position is oxidized, and the 3-position carbon is an ester with the carboxyl group of the aforementioned isoquinoline carboxylic acid, and the 3-position carbon
Overall, the structure of this compound is formed by esterification of the isoquinoline carboxylic acid part containing a specific substituent and stereo configuration, and the azabicyclic ester group part with a specific oxidation state and stereo configuration. The unique structure of the compound must give it specific chemical and physical properties, and may have unique uses in chemistry and related fields.
What are the physical properties of (1S) -3, 4-dihydro-1-phenyl-2 (1H) -isoquinolinecarboxylic Acid (3R) -1-Oxido-1-azabicyclo [2.2.2] oct-3-yl Ester
(This substance is (1S) -3,4 -dihydro-1 -phenyl-2 (1H) -isoquinoline carboxylic acid (3R) -1 -oxidized-1 -azabicyclic [2.2.2] octyl-3 -yl ester)
This substance has many physical properties. Its appearance may be white to off-white crystalline powder with fine texture, which is a common appearance morphology of many organic compounds, and the regular crystalline structure can be seen under the microscope. < Br >
Melting point is an important physical constant, or in a specific temperature range, such as between [X] ° C and [X] ° C. Melting point determination requires precise thermal analysis instruments and operates according to specific experimental procedures. This value is of great significance for the purity and structure identification of substances.
In terms of solubility, it varies in organic solvents. Common organic solvents such as ethanol and chloroform may have certain solubility and can form a homogeneous solution. This property is due to the force between molecules and solvent molecules. However, in water, or poor solubility, because its molecular structure contains more hydrophobic groups, resulting in weak hydrophilicity. < Br >
The density may be [X] g/cm ³, and the determination requires an accurate density measurement device. The density reflects the mass per unit volume of the substance, which is of great significance for the study of the behavior of the substance in a specific environment.
In addition, the substance may have a certain stability. Under normal temperature and pressure, the chemical structure can be maintained relatively stable, but under extreme conditions such as high temperature, strong acid, and strong alkali, or chemical reactions occur, causing structural changes.
What is the main use of (1S) -3, 4-dihydro-1-phenyl-2 (1H) -isoquinolinecarboxylic Acid (3R) -1-Oxido-1-azabicyclo [2.2.2] oct-3-yl Ester
(This compound) (1S) -3,4-dihydro-1-phenyl-2 (1H) -isoquinoline carboxylic acid (3R) -1-oxo-1-azabicyclo [2.2.2] octyl-3-yl ester, its main use is related to the exploration and application in the field of medicine.
The structure of this compound has a unique spatial configuration and chemically active group. In the process of pharmaceutical development, or due to structural characteristics, it can show affinity and efficacy for specific biological targets.
As far as pharmacological mechanisms are concerned, they may affect relevant physiological and biochemical processes by interacting with key proteins, enzymes or receptors in the body. For example, some compounds containing structures similar to azabicyclo and isoquinoline can modulate neurotransmitter transmission and have potential value in the treatment of neurological diseases. This compound may also have similar effects. It may act on nerve cell surface receptors, modulate nerve signaling, and help heal neurological diseases such as epilepsy and Parkinson's disease.
Furthermore, in the field of cardiovascular diseases, some substances with similar structures can regulate the relevant ion channels or signaling pathways of the cardiovascular system. This compound may regulate cardiovascular physiological functions through a similar mode of action, such as regulating blood pressure, heart rhythm, etc., providing a new path for the prevention and treatment of cardiovascular diseases.
In addition, in anti-tumor research, its special structure may endow the potential to inhibit tumor cell proliferation and induce tumor cell apoptosis, and achieve the purpose of anti-tumor by interfering with key metabolic pathways or signal transduction pathways of tumor cells.
In short, this compound has rich potential uses in many fields of medicine due to its unique chemical structure, opening up broad prospects for the research and development of disease treatment drugs.
What are the synthesis methods of (1S) -3, 4-dihydro-1-phenyl-2 (1H) -isoquinolinecarboxylic Acid (3R) -1-Oxido-1-azabicyclo [2.2.2] oct-3-yl Ester
The synthesis of (1S) -3,4-dihydro-1-phenyl-2 (1H) -isoquinoline carboxylic acid (3R) -1-oxidized-1-azabicyclo [2.2.2] octyl-3-yl esters covers a variety of pathways.
First, it can be obtained from the starting material through a multi-step reaction. First, a suitable phenyl compound is taken and condensed with a nitrogen-containing heterocyclic precursor under specific conditions. This condensation reaction requires fine regulation of the reaction temperature, reaction duration and proportion of reactants. Usually, under mild heating and inert gas protection atmosphere, the two interact to form a preliminary skeleton structure.
Then, the preliminary product is oxidized and modified. A suitable oxidizing agent, such as some high-valent metal oxides or peroxides, is selected to promote an oxidation reaction at a specific location in a suitable solvent system to introduce the desired oxidation group, thereby constructing a specific configuration of (3R) -1-oxidized -1-azabicyclo [2.2.2] octyl-3-base part.
Furthermore, for the isoquinoline carboxylic acid part, it can be prepared by carboxylation of the corresponding isoquinoline derivative. This carboxylation reaction may depend on specific catalysts and reaction aids to precisely connect the carboxyl groups to the designated positions of the isoquinoline ring under suitable pH and temperature environments.
Finally, the two parts prepared by the above steps will be esterified under the action of a condensing agent. The selection of the condensing agent is crucial to effectively promote the combination of the two while avoiding unnecessary side reactions. By precisely controlling the reaction conditions, (1S) -3,4-dihydro-1-phenyl-2 (1H) -isoquinoline carboxylic acid (3R) -1-oxo-1-azabicyclo [2.2.2] octyl-3-yl ester can be successfully synthesized. In this synthesis process, every step needs to be carefully controlled and the reaction conditions are carefully controlled to obtain the ideal yield and purity.
(1S) -3, 4-dihydro-1-phenyl-2 (1H) -isoquinolinecarboxylic Acid (3R) -1-Oxido-1-azabicyclo [2.2.2] What are the applications of oct-3-yl Ester in the field of medicine
(This compound is used in the field of medicine as follows)
My view of this ((1S) -3,4-dihydro-1-phenyl-2 (1H) -isoquinoline carboxylic acid (3R) -1 -oxidized-1-azabicyclo [2.2.2] octyl-3-yl ester) is widely used in the field of medicine.
One of them may be used in the research and treatment of diseases related to the nervous system. It has a unique structure and may interact with neurotransmitter receptors to regulate the transmission of nerve signals. Such as epilepsy, the disease is mostly caused by abnormal discharge of nerve cells. This compound may stabilize the membrane potential of nerve cells, inhibit abnormal discharge, and then slow down the onset of epilepsy.
Second, it also has potential in cardiovascular diseases. It may affect the contraction and relaxation of vascular smooth muscles and regulate blood pressure. If blood vessels constrict convulsively, blood pressure will rise easily, and this agent may dilate blood vessels, reduce blood pressure to normal, and treat hypertension.
Furthermore, it is also promising in the way of anti-tumor. Its structure may interfere with the metabolic process of tumor cells, or hinder the formation of tumor blood vessels, causing tumor cells to lose nutrient supply, thereby inhibiting the growth and spread of tumors.
However, the use of medicine is not achieved overnight, and many experimental verifications are needed to explore its efficacy, safety, side effects, etc. It must be carefully studied before it can be applied to the clinic and save patients from pain.