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What is the chemical structure of N- [ (4,6-dimethoxypyrimidine-2-yl) aminoformyl] -3- (ethylsulfonyl) pyridine-2-sulfonamide
This is to explore the chemical structure of N- [ (4,6-diethoxybenzoyl-2-yl) aminobenzoyl] -3- (ethoxybenzoyl) -2-benzamide. This molecule has a complex structure and is composed of many parts.
Looking at the first part, (4,6-diethoxybenzoyl-2-yl) aminobenzoyl group, containing benzene ring, diethoxy group at position 4 and 6, and aminobenzoyl group at position 2. The ethoxy group is alkoxy, which has the electron supply effect and affects the electron cloud density and chemical activity of the benzene ring. The aminobenzoyl group also affects the molecular properties and reactivity.
Middle 3- (ethoxybenzoyl), benzene ring 3-position ethoxybenzoyl group, ethoxy group affects the activity of benzoyl group and the overall properties of the molecule.
Tail 2-benzamide, benzene ring 2-linked formamide group, formamide group contains carbonyl and amino group, which has a certain reactivity and hydrogen bonding ability, and has a great influence on molecular properties.
As a whole, this compound is connected by multiple benzene rings and different substituents, and each substituent affects each other to determine its physical and chemical properties. Its complex structure endows a variety of chemical activities, or can be used for specific chemical reactions and material preparation, and may have potential application value in organic synthesis, medicinal chemistry and other fields.
What is the main use of N- [ (4,6-dimethoxypyrimidine-2-yl) aminoformyl] -3- (ethylsulfonyl) pyridine-2-sulfonamide
N- [ (4,6-diethoxybenzoyl-2-yl) aminoethyl] -3- (ethoxyphenyl) ethylene-2-ylbenzamide, which has a wide range of uses. In the field of medicine, it can be used as a key intermediate to help the development of new drugs. For example, in the development of anti-tumor drugs, its structural properties may interact with specific targets of tumor cells, interfering with the growth and proliferation of tumor cells, providing a new opportunity to overcome cancer problems; in cardiovascular drugs, or by regulating some physiological mechanisms of the body, such as affecting vasodilation and contraction-related pathways, play a positive role in the treatment of cardiovascular diseases.
In the field of materials science, this substance exhibits unique properties or can be used to prepare special functional materials. For example, it is used to make materials with specific optical properties. In optoelectronic devices, it is used in optical sensors, Light Emitting Diodes, etc. by virtue of its absorption, emission or refraction of light, etc., to improve the performance and function of optoelectronic devices.
In the field of organic synthesis, it serves as an important synthetic building block for the construction of complex organic molecular structures. Chemists can use its special structure and activity check point to synthesize more organic compounds with novel structures and unique functions through various organic reactions, such as nucleophilic substitution and addition reactions, etc., expanding the boundaries of organic synthesis chemistry and injecting new vitality into the development of related fields.
What are the synthesis methods of N- [ (4,6-dimethoxypyrimidine-2-yl) aminoformyl] -3- (ethylsulfonyl) pyridine-2-sulfonamide
To prepare N - [ (4,6 - diethoxycarbonyl - 2 - aminophenyl) acetamido] - 3 - (ethylsulfonamido) phenylacetamide - 2 - sulfonamide, there are three methods.
First, start with 4,6 - diethoxycarbonyl - 2 - nitrobenzoic acid, first heat it with sulfuryl chloride to obtain the corresponding acid chloride, and then react with 2 - aminophenylacetamide to obtain the amide product. Subsequently, iron powder and hydrochloric acid are used to reduce the nitro group to an amino group, and then reacted with ethanesulfonyl chloride to obtain N- [ (4,6-diethoxycarbonyl-2-aminophenyl) acetamido] -3- (ethanesulfonamido) phenylacetamide. Finally, this product is reacted with chlorosulfonic acid to obtain the target product.
Second, start with 2-nitro-4,6-dihydroxybenzoic acid, and first react with diethyl sulfate to make hydroxyethoxylated to give 4,6-diethoxy-2-nitrobenzoic acid. The next step is similar to the first method, first forming an acid chloride, reacting with 2-aminophenylacetamide, then reducing the nitro group, reacting with ethanesulfonyl chloride, and finally reacting with chlorosulfonic acid to obtain the target product.
Third, starting with 2-amino-4,6-dihydroxybenzoic acid, first reacting with chloroacetyl chloride to obtain 2- (chloroacetamido) -4,6-dihydroxybenzoic acid. Then reacting with diethyl sulfate to make hydroxyethoxylation. Then reacting with 3-ethanesulfonamido-2-sulfonyl chlorophenylacetamide, the target product is obtained by condensation.
Each of these three methods has its own advantages and disadvantages. The first method is easy to purchase raw materials, and the steps are relatively simple, but the reduction steps may contain impurities. The second method has different starting materials, and the operation is slightly complicated. The three methods have unique steps, and the conditions of each step also need to be carefully investigated. The target product can be obtained, but the actual application needs to be selected according to the situation.
What is the safety of N- [ (4,6-dimethoxypyrimidine-2-yl) aminoformyl] -3- (ethylsulfonyl) pyridine-2-sulfonamide
How safe is N - [ (4,6-diethoxybenzoyl-2-yl) aminoethyl] -3- (ethoxyphenyl) to its-2-benzamide? The structure of this substance is complex, and its safety needs to be investigated from multiple ends.
Looking at its chemical structure, it contains benzene ring, amide group, ethoxy group and other groups. The structure of the benzene ring is stable, but some benzene ring-containing compounds may be potentially toxic, because the benzene ring can participate in a variety of biochemical reactions, or generate harmful substances when metabolized in the body. Amide groups are common in many drugs and bioactive molecules. Generally speaking, amide compounds are relatively stable and biocompatible, but it also depends on the surrounding group environment. Ethoxy groups are lipophilic groups, or affect the solubility and membrane permeability of substances. Too many lipophilic groups or substances accumulate in adipose tissue in the body, leading to potential health risks.
When it comes to safety, its toxicological properties need to be considered. In terms of acute toxicity, if a large amount of intake or contact, or irritate the skin, eyes and respiratory tract, cause redness, pain, cough and other symptoms. Long-term toxicity cannot be ignored. Long-term low-dose exposure may interfere with normal physiological processes in the body, such as affecting endocrine system and immune system function. And because it contains multiple groups, or has the risk of mutagenicity and carcinogenicity, it needs to be confirmed by rigorous experiments, such as Ames test, cell chromosome aberration test, etc.
Review its use scenarios and exposure routes. If it is used in industrial production, workers may be exposed by inhalation or skin contact during the production process, and good ventilation and protective measures are required to reduce the risk of exposure. If it is used for medical use, it needs to undergo rigorous clinical trials to evaluate the efficacy and carefully observe the adverse reactions and safety.
In summary, only based on the existing structural information, the safety of refractory N- [ (4,6-diethoxybenzoyl-2-yl) aminoethyl] -3- (ethoxyphenyl) to its -2-benzamide depends on comprehensive toxicological studies and actual use scenario evaluation.
How competitive is N- [ (4,6-dimethoxypyrimidine-2-yl) aminoformyl] -3- (ethylsulfonyl) pyridine-2-sulfonamide in the market?
The competitiveness of N- [ (4,6-diethoxybenzoyl-2-yl) aminoethyl] -3- (ethoxyphenyl) -2-phenylpyridine in the market is related to its floating and sinking in Shanghai.
Looking at this compound, its unique structure, the 4,6-diethoxybenzoyl-2-yl part, such as the cornerstone of a building, gives the molecule a specific spatial configuration and electronic effects. The presence of ethoxy groups may regulate the hydrophobicity of molecules and affect their ability to bind to biological targets. The introduction of aminoethyl group seems to add a smart arm to the molecule, which can participate in many biological interactions, such as the formation of hydrogen bonds with receptors, which may be of great significance to improve its biological activity.
Furthermore, the 3- (ethoxyphenyl) -2 -phenylpyridine fragment is like the pearl of the crown. The rigid structure of phenyl can enhance the planarity of the molecule, which is conducive to π-π stacking, or can enhance the stability of binding to targets. The modification of ethoxyphenyl adds different electronic properties to the molecule, which affects the charge distribution, and then affects the interaction mode with biological macromolecules.
However, looking at the market competition, this compound faces many challenges. The difficulty of synthesis may be one of them. The unique structure means a complex synthesis route, requiring precise reaction conditions and superb synthesis skills, which will undoubtedly increase production costs and weaken price competitiveness.
Biological activity verification is also the key. Although the structure indicates good activity, it needs to be confirmed by strict experiments. If the activity does not meet expectations, the vertical structure is exquisite, and it is difficult to win the favor of the market.
And congeneric products in the market may have been preconceived and occupy a certain share. N- [ (4,6-diethoxybenzoyl-2-yl) aminoethyl] -3- (ethoxyphenyl) -2-phenylpyridine needs unique advantages, such as higher activity, lower toxicity, and better selectivity, in order to emerge in the highly competitive market and gain a share of the pie.