Chemical Name | (4aR,4bS,6aS,7S,9aS,9bS,11aR)-N-tert-butyl-4a,6a-dimethyl-2-oxo-2,4a,4b,5,6,6a,7,8,9,9a,9b,10,11,11a-tetradecahydro-1H-indeno[5,4-f]quinoline-7-carboxamide |
Molecular Formula | C26H40N2O2 |
Molecular Weight | 412.61 g/mol |
Physical State | Solid (predicted) |
Solubility | Poorly soluble in water (predicted) |
Logp | High (lipophilic, predicted) |
Stability | Stable under normal conditions (predicted) |
Color | Colorless to white (predicted) |
What is the chemical structure of (4aR, 4bS, 6aS, 7S, 9aS, 9bS, 11aR) -N-tert-butyl-4a, 6a-dimethyl-2-oxo-2,4a, 4b, 5,6,6a, 7,8,9,9a, 9b, 10,11, 11a-tetradecahydro-1H-indeno [5,4-f] quinoline-7-carboxamide?
This is the chemical name of (4aR, 4bS, 6aS, 7S, 9aS, 9bS, 11aR) -N-tert-butyl-4a, 6a-dimethyl-2-oxo-2,4a, 4b, 5,6,6a, 7,8,9,9a, 9b, 10,11,11a-tetradecyl-1H-indeno [5,4-f] quinoline-7-formamide. To know its chemical structure, it is necessary to specify the structural information contained in this naming convention.
" (4aR, 4bS, 6aS, 7S, 9aS, 9bS, 11aR) " is the configuration designation of the chiral center, indicating a specific atomic spatial arrangement. " "N-tert-butyl", indicating that the nitrogen atom is connected to the tert-butyl group, that is, the -C (CH <) < structure. "4a, 6a-dimethyl", showing that the carbon atoms at positions 4a and 6a are each connected to a methyl group (-CH <).
"2-oxo", Table 2 has a carbonyl group (C = O) at position 2. " 2,4a, 4b, 5, 6, 6a, 7, 8, 9, 9a, 9b, 10, 11, 11a - tetradecyl - 1H - indeno [5, 4 - f] quinoline ", revealing that the parent nuclear structure is indenoquinoline, and hydrogenated at many of the above positions." -7 - formamide "refers to the presence of a formamide group (-CONH) at position 7. According to this analysis, its chemical structure can be roughly drawn: with the indenoquinoline fused ring system as the core, methyl is added at the 4a and 6a positions, carbonyl at the 2 position, formamide at the 7 position, and tert-butyl at the nitrogen atom. Each chiral center arranges the atomic spatial orientation according to the standard configuration, and the rings are connected according to the saturation of the hydrogen atom in the name, so as to construct the chemical structure of this compound.
(4aR, 4bS, 6aS, 7S, 9aS, 9bS, 11aR) -N-tert-butyl-4a, 6a-dimethyl-2-oxo-2,4a, 4b, 5,6,6a, 7,8,9,9a, 9b, 10,11, 11a-tetradecahydro-1H-indeno [5,4-f] What are the physical properties of quinoline-7-carboxamide?
(4aR, 4bS, 6aS, 7S, 9aS, 9bS, 11aR) -N-tert-butyl-4a, 6a-dimethyl-2-oxo-2,4a, 4b, 5,6,6a, 7,8,9,9a, 9b, 10,11,11a-tetradecyl-1H-indeno [5,4-f] quinoline-7-formamide, which is a complex organic compound. Its physical properties are as follows:
- ** Appearance and Properties **: Under normal temperature and pressure, it is mostly solid. Due to the complex molecular structure and the interaction between atoms, the molecules are closely arranged, and then it presents a solid state. However, if there are specific groups such as long-chain alkyl groups in the molecule, or due to the weakening of the force between the groups, it will be liquid in the appropriate temperature range.
- ** Melting Point and Boiling Point **: The melting point and boiling point are relatively high. The compound has a large molecular weight and there are many interactions in the structure, such as van der Waals force, hydrogen bond, etc. Among them, the covalent bond between the atoms in the molecule is stable, and the interaction between molecules is also strong. To make the molecule get rid of the lattice binding or overcome the intermolecular force into a gaseous state requires more energy, so the melting boiling point is high. However, the exact melting boiling point value is affected by factors such as the specific structure, crystal form and purity of the molecule.
- ** Solubility **: In view of the fact that its molecules contain polar amide groups (-CONH-) and non-polar alkyl, aryl and other groups, their solubility in organic solvents is unique. In polar organic solvents such as dimethyl sulfoxide (DMSO), N, N-dimethylformamide (DMF), amide groups can interact with solvent molecules to form hydrogen bonds and have a certain solubility; in non-polar organic solvents such as n-hexane, due to the weak force between the non-polar part of the molecule and the solvent molecule, the solubility is very small. In water, although there are polar amide groups, the large non-polar structure accounts for a large proportion, and the whole is not conducive to the formation of effective interaction with water molecules, so the solubility is low.
(4aR, 4bS, 6aS, 7S, 9aS, 9bS, 11aR) -N-tert-butyl-4a, 6a-dimethyl-2-oxo-2,4a, 4b, 5,6,6a, 7,8,9,9a, 9b, 10,11, 11a-tetradecahydro-1H-indeno [5,4-f] What are the main uses of quinoline-7-carboxamide?
(4aR, 4bS, 6aS, 7S, 9aS, 9bS, 11aR) -N-tert-butyl-4a, 6a-dimethyl-2-oxo-2,4a, 4b, 5, 6, 6a, 7, 8, 9, 9a, 9b, 10, 11, 11a-tetrahydro-1H-indono [5, 4-f] quinoline-7-formamide, this is an organic compound. Its main uses are wide, and it can be used as a potential pharmaceutical ingredient in the field of medicine. Due to the unique chemical structure of this compound, or its specific biological activity, it can interact with specific targets in organisms, and is expected to be developed as a drug for the treatment of diseases, such as for some difficult diseases, or can play a key role.
In the field of organic synthesis chemistry, it can serve as an important intermediate. Due to its complex and characteristic structure, organic synthesis chemists can perform various chemical reactions on it, introduce different functional groups, and construct more complex and special organic compounds, which can help create new materials and functional molecules.
In the early research of drug development, this compound may be a lead compound. Researchers can use this as a basis to improve its pharmacological activity and reduce toxic and side effects through structural modification and optimization, laying a solid foundation for the development of new drugs and promoting the progress of pharmaceutical science.
(4aR, 4bS, 6aS, 7S, 9aS, 9bS, 11aR) -N-tert-butyl-4a, 6a-dimethyl-2-oxo-2,4a, 4b, 5,6,6a, 7,8,9,9a, 9b, 10,11, 11a-tetradecahydro-1H-indeno [5,4-f] What are the synthesis methods of quinoline-7-carboxamide?
To prepare (4aR, 4bS, 6aS, 7S, 9aS, 9bS, 11aR) -N-tert-butyl-4a, 6a-dimethyl-2-oxo-2,4a, 4b, 5,6,6a, 7,8,9,9a, 9b, 10,11,11a-tetradecyl-1H-indeno [5,4-f] quinoline-7-formamide, the synthesis method can be explored from multiple ways.
First, with suitable starting materials, the core skeleton of indoquinoline is constructed through cyclization reaction. Such as selecting aromatic compounds with specific substituents and enamines, under suitable catalysts and reaction conditions, the tandem reaction of nucleophilic addition and cyclization is one of the key steps. In the meantime, the choice of catalysts is crucial, such as Lewis acid or transition metal catalysts, which can effectively promote the reaction process and improve the selectivity and yield of the reaction.
Furthermore, for the modification of key functional groups. After the skeleton is formed, the substituents at specific positions are precisely introduced and modified. To obtain the structure of 4a, 6a-dimethyl, the alkylation reaction can be carried out at a specific reaction check point through suitable alkylation reagents. The introduction of N-tert-butyl and 7-formamide also requires the selection of appropriate reagents and conditions. For example, the N-tert-butyl-7-formamide structure in the target molecule can be obtained by the acylation reaction of tert-butyl amine and the corresponding acylating reagents.
In addition, the fine regulation of the reaction conditions cannot be ignored. Temperature, reaction time, and the type of solvent all have a significant impact on the process and result of the reaction. Moderate temperature and appropriate reaction time can ensure that the reaction is fully carried out and side reactions are avoided. The appropriate solvent can not only dissolve the reactants, but also affect the rate and selectivity of the reaction.
Synthesis of (4aR, 4bS, 6aS, 7S, 9aS, 9bS, 11aR) -N-tert-butyl-4a, 6a-dimethyl-2-oxo-2,4a, 4b, 5,6,6a, 7,8,9,9a, 9b, 10,11,11a-tetradecyl-1H-indeno [5,4-f] quinoline-7-formamide requires clever design and fine regulation of each reaction step to achieve efficient and accurate synthesis.
(4aR, 4bS, 6aS, 7S, 9aS, 9bS, 11aR) -N-tert-butyl-4a, 6a-dimethyl-2-oxo-2,4a, 4b, 5,6,6a, 7,8,9,9a, 9b, 10,11, 11a-tetradecahydro-1H-indeno [5,4-f] What is the market outlook for quinoline-7-carboxamide?
Today, there is a product called\ ((4aR, 4bS, 6aS, 7S, 9aS, 9bS, 11aR) -N-tert-butyl-4a, 6a-dimethyl-2-oxo-2,4a, 4b, 5,6,6a, 7,8,9,9a, 9b, 10,11,11a-tetrahydrogen- 1H-indeno [5,4-f] quinoline-7-formamide\). The market prospect of this product is quite interesting.
Its chemical structure is complex and exquisite, or it has unique physical and chemical properties and biological activities. In the field of medicine, or due to its special structure, it can interact with specific biological targets, and it is expected to be developed as a new type of drug to treat various diseases. If it has significant affinity and regulatory effect on the targets of some difficult diseases, it will arouse strong interest from pharmaceutical developers, and the market prospect may be bright.
In the field of materials science, its special structure may endow materials with novel properties. For example, it can be used as a functional additive in new polymer materials to improve the stability, optical properties or electrical properties of materials. If successfully applied, it will open up new material markets to meet the needs of different industries for special performance materials.
However, its market road is not smooth. Synthesis of this compound may require complex processes and high costs, which may limit its large-scale production and application. And the research and development of new drugs requires long and rigorous clinical trials to prove their safety and effectiveness, which is time-consuming and laborious, and risky. In terms of material application, many technical problems such as compatibility with other materials also need to be solved.
In summary,\ ((4aR, 4bS, 6aS, 7S, 9aS, 9bS, 11aR) -N-tert-butyl-4a, 6a-dimethyl-2-oxo-2,4a, 4b, 5,6,6a, 7,8,9,9a, 9b, 10,11,11a-tetrahydrogen- 1H-indeno [5,4-f] quinoline-7-formamide\) has a potentially broad market prospect, but the road ahead is full of thorns, and researchers and the industry need to work together to overcome difficulties in order to see its brilliant market future.