Chemical Name | 2-Fluoro-4-[7-(quinolin-6-ylmethyl)imidazo[1,2-b][1,2,4]triazin-2-yl]benzoic acid—hydrogen chloride (1/2) |
Molecular Formula | C24H16ClFN6O2 |
Molecular Weight | 476.87 g/mol |
Appearance | Solid (predicted) |
Melting Point | No data available |
Boiling Point | No data available |
Pka | No data available |
Logp | No data available |
Chemical Structure | Complex organic structure with imidazo[1,2-b][1,2,4]triazine, quinoline, and benzoic acid moieties |
Chemical Name | 2-Fluoro-4-[7-(quinolin-6-ylmethyl)imidazo[1,2-b][1,2,4]triazin-2-yl]benzoic acid—hydrogen chloride (1/2) |
Molecular Formula | C25H17ClF3N5O2 |
Molecular Weight | 511.88 g/mol |
Chemical Name | 2-Fluoro-4-[7-(quinolin-6-ylmethyl)imidazo[1,2-b][1,2,4]triazin-2-yl]benzoic acid—hydrogen chloride (1/2) |
Molecular Formula | C25H18ClFN6O2 |
Molecular Weight | 490.89 g/mol |
Appearance | Solid (predicted) |
Physical State | Solid at room temperature |
Solubility | Solubility properties depend on solvent; may be sparingly soluble in water |
Pka | Values related to acidic groups would exist, but specific values need experimental determination |
Melting Point | Melting point data would require experimental measurement |
Boiling Point | Boiling point difficult to estimate without experimental data, likely high due to structure |
Stability | Stability in different conditions (light, heat, air) would need to be tested; potentially stable under normal conditions |
Odor | Odorless (predicted) |
Chemical Name | 2-Fluoro-4-[7-(quinolin-6-ylmethyl)imidazo[1,2-b][1,2,4]triazin-2-yl]benzoic acid—hydrogen chloride (1/2) |
What is the chemical structure of 2-Fluoro-4- [7- (quinoline-6-ylmethyl) imidazo [1,2-b] [1,2,4] triazin-2-yl] benzoic acid - hydrogen chloride (1/2)?
This is an investigation into the chemical structure of 2-fluoro-4- [7 - (quinoline-6-ylmethyl) imidazolo [1,2-b] [1,2,4] triazine-2-yl] benzoic acid-hydrogen chloride (1/2). Its chemical structure is composed of many parts.
In the main body of the molecule, the benzoic acid part is the basic structure, and the benzene ring is above the benzene ring. There are fluorine atoms at 2 positions, and the complex heterocyclic ring structure at 4 positions is connected by chemical bonds. The heterocyclic structure is 7- (quinoline-6-ylmethyl) imidazolo [1,2-b] [1,2,4] triazine-2-yl.
The imidazolo [1,2-b] [1,2,4] triazine part is formed by fusing the imidazolo ring with the [1,2,4] triazine ring. The 7-position is connected to the quinoline-6-ylmethyl. The quinoline is a nitrogen-containing heterocyclic ring. The 6-position is connected to the methyl group and then connected to the 7-position imidazolo [1,2-b] [1,2,4] triazine.
And "-hydrogen chloride (1/2) " indicates that the compound is hemihydrochloride, which means that every two host molecules bind a molecule of hydrogen chloride, which is combined by ionic bonds and other interactions to form a compound with this specific chemical structure. This structure gives the compound unique chemical and physical properties, which may have specific uses and reactivity in fields such as chemical synthesis and drug development.
What are the main uses of 2-Fluoro-4- [7- (quinoline-6-ylmethyl) imidazo [1,2-b] [1,2,4] triazin-2-yl] benzoic acid - hydrogen chloride (1/2)?
2-Fluoro-4- [7- (quinoline-6-ylmethyl) imidazolo [1,2-b] [1,2,4] triazine-2-yl] benzoic acid-hydrogen chloride (1/2), this is a rather complex organic compound. Its main uses are wide, and it is often used as a key intermediate in the field of medical chemistry. Gein organic synthesis is exquisite, this compound has a unique structure, has a specific activity check point, and can be derived from bioactive drug molecules through clever chemical reactions, paving the way for the development of new drugs.
In the process of drug development, it may be possible to construct small molecule drugs that are suitable for specific disease targets, such as some cancer-related targets. By modifying the structure of this compound, regulating its ability to bind to the target, improving drug efficacy and reducing side effects.
In addition, in the field of chemical research, as a unique structural unit, it helps to explore novel reaction mechanisms and synthesis strategies. Chemists can explore its reaction characteristics, expand the boundaries of organic chemistry knowledge, and provide ideas and methods for the synthesis of more complex and delicate organic molecules. In short, this compound has important potential value in the fields of medicine and chemistry, and is of great significance for promoting the development of related fields.
What is the synthesis method of 2-Fluoro-4- [7- (quinoline-6-ylmethyl) imidazo [1,2-b] [1,2,4] triazin-2-yl] benzoic acid - hydrogen chloride (1/2)?
The synthesis of 2-fluoro-4- [7- (quinoline-6-methyl) imidazolo [1,2-b] [1,2,4] triazine-2-yl] benzoic acid-hydrogen chloride (1/2) is an important matter in organic synthesis. The way of its synthesis should follow the principles of organic chemistry and use clever methods to polymerize the reactants to form this specific structure.
At first, suitable starting materials can be found, such as fluorine-containing benzoic acid derivatives, and intermediates containing quinoline and imidazolo-triazine structures. In order to connect the two, appropriate reaction conditions and reagents need to be selected. Or by means of a coupling reaction, such as palladium-catalyzed coupling, the two can form bonds under mild conditions. In this process, the choice of solvent is very critical, and those that can dissolve the reactants and are favorable for the reaction should be selected, such as polar aprotic solvents such as N, N-dimethylformamide.
In addition, the temperature and time of the reaction also need to be carefully controlled. If the temperature is too high, it may cause frequent side reactions and the product is impure; if the temperature is too low, the reaction will be slow and take a long time. Therefore, the optimal temperature needs to be found according to the characteristics of the reaction, or between room temperature and moderate heating. The time also depends on the reaction process. It is often monitored by thin-layer chromatography. When the raw materials are almost exhausted and the product formation reaches the expected level, the reaction will be stopped.
The introduction of hydrogen chloride may be introduced into the reaction system with hydrogen chloride gas in the later stage of synthesis, or a suitable hydrogen chloride donor can be added to make the desired hydrochloride form. This process also needs to pay attention to the conditions to avoid damage to other parts of the molecule.
When synthesizing, it is necessary to pay attention to the separation and purification of each step. Silica gel column chromatography, recrystallization, etc. are used to remove impurities and keep purity to obtain high-purity target products. In this way, after many careful operations, 2-fluoro-4- [7- (quinoline-6-ylmethyl) imidazolo [1,2-b] [1,2,4] triazine-2-yl] benzoic acid-hydrogen chloride (1/2) can be obtained.
What are the physical and chemical properties of 2-Fluoro-4- [7- (quinoline-6-ylmethyl) imidazo [1,2-b] [1,2,4] triazin-2-yl] benzoic acid - hydrogen chloride (1/2)?
2-Fluoro-4- [7- (quinoline-6-ylmethyl) imidazolo [1,2-b] [1,2,4] triazine-2-yl] benzoic acid-hydrogen chloride (1/2), this is an organic compound. Its physical and chemical properties, let me elaborate.
First talk about the appearance, this material is often in a solid state, the specific color state may vary depending on the purity and conditions of preparation, or it is a white to off-white powder, just like the fine snow that falls in the early winter, or it is a tiny crystal, like a shining ice crystal.
In terms of solubility, its solubility in water is not good, because the molecular structure contains many hydrophobic groups, such as quinoline group, imidazole and triazine group, etc. These structures are like barriers to water repellency, making it difficult for water molecules to blend with them. However, in organic solvents, such as dimethyl sulfoxide (DMSO), N, N-dimethylformamide (DMF) and other polar organic solvents, but there is a certain solubility, because the polarity of these solvents coincides with the polarity of some groups of the compound, and they can be dissolved with similar compatibility. The melting point of
is also an important physical property. After determination, its melting point is in a specific temperature range. This temperature is the critical temperature for the conversion of the solid state and the liquid state of the compound, reflecting the strength of the intermolecular forces. Interactions such as van der Waals forces and hydrogen bonds exist between the molecules of the compound, which jointly maintain the structure of the solid state. When the temperature rises to the melting point, the molecules obtain enough energy to break free from these forces and transform from a solid state to a liquid state.
Besides chemical properties, the benzene ring, quinoline ring and imidazolo triazine ring of the compound give it a certain stability, but the fluorine atom, carboxyl group and nitrogen atom on the triazine ring attached to the ring are active check points, making it chemically reactive. The carboxyl group can neutralize with the base, just like the ancient game between acid and base, generating the corresponding carboxylate; although the fluorine atom is relatively stable, under certain conditions, it can participate in the nucleophilic substitution reaction, as if it plays a unique role in the chemical stage, being replaced by nucleophilic reagents to derive new compounds. The nitrogen atom on the imidazole triazine ring can participate in the coordination reaction as an electron donor and form complexes with metal ions, etc., opening up new fields for chemical research.
What is the market outlook for 2-Fluoro-4- [7- (quinoline-6-ylmethyl) imidazo [1,2-b] [1,2,4] triazin-2-yl] benzoic acid - hydrogen chloride (1/2)?
Today there are 2 - Fluoro - 4 - [7 - (quinolin - 6 - ylmethyl) imidazo [1,2 - b] [1,2,4] triazin - 2 - yl] benzoic acid - hydrogen chloride (1/2), and its market prospect is related to many parties. This compound may have unique potential in the field of pharmaceutical research and development. Watching the rise of new pharmaceutical products in the past, there are those who have found new therapeutic paths due to their unique chemical structure. If the structural properties of this compound can fit specific disease targets, such as certain cancer and inflammation-related targets, it may become the basis for new drugs.
In the evolution of medicinal chemistry, many compounds containing heterocyclic structures have emerged. The heterocyclic structures such as imidazolo-triazine and quinoline in this compound may endow it with good biological activity and pharmacokinetic properties. If the research and development goes well, it can become the core ingredient of patented drugs and enjoy the exclusive benefits of the market during the patent protection period.
Furthermore, in the chemical industry, the demand for fine chemicals is increasing. This compound may be a high-end fine chemical raw material for the synthesis of more complex functional materials. However, its marketing activities also face challenges. R & D costs are high, and many technical barriers need to be overcome from laboratory synthesis to industrial production. And the market competition is fierce, and similar or alternative compounds are also competing for market share. If you want to stand out in the market, you must strike a delicate balance between R & D efficiency, product quality and cost control, and you are expected to open up a broad market prospect.