3s 2 N 2s 1 Ethoxy 1 Oxo 4 Phenylbutan 2 Yl L Alanyl 1 2 3 4 Tetrahydroisoquinoline 3 Carboxylic Acid
quinoline thiophene imidazole thiazole

(3S)-2-{N-[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]-L-alanyl}-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid

Taiy Chemical

    Specifications

    HS Code

    240173

    Chemical Formula C28H34N2O6
    Molecular Weight 494.58 g/mol
    Iupac Name (3S)-2-{N-[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]-L-alanyl}-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
    Chirality Multiple chiral centers (S configurations indicated in name)
    Physical State Predicted Solid (due to relatively large molecular size and presence of polar groups)
    Solubility Expected to be sparingly soluble in water, more soluble in polar organic solvents like DMSO or methanol
    Pka Approximate Carboxylic acid group likely around 3 - 5, amide NH may have pKa in high teens
    Melting Point Predicted Relatively high, likely above 150°C due to intermolecular hydrogen bonding
    Boiling Point Predicted Very high, decomposition likely occurs before reaching boiling point
    Functional Groups Carboxylic acid, amide, tetrahydroisoquinoline ring, phenyl group, ethoxycarbonyl group

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    Frequently Asked Questions

    As a leading (3S)-2-{N-[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]-L-alanyl}-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid supplier, we deliver high-quality products across diverse grades to meet evolving needs, empowering global customers with safe, efficient, and compliant chemical solutions.

    What is the chemical structure of (3S) 2- {N- [ (2S) -1-ethoxy-1-oxo-4-phenylbutan-2-yl] -L-alanyl} -1,2,3, 4-tetrahydroisoquinoline-3-carboxylic acid
    The chemical structure of (3S) - 2 - {N - [ (2S) - 1 - ethoxy - 1 - oxo - 4 - phenylbutyl - 2 - yl] - L - alanyl} - 1,2,3,4 - tetrahydroisoquinoline - 3 - carboxylic acid, according to the ancient classical text of "Tiangong Kaiwu", can be described as follows:
    This compound is an organic molecule with a specific spatial configuration. Its main structure contains tetrahydroisoquinoline - 3 - carboxylic acid part, and has the S configuration at the 3rd carbon position. In the second position of this structure, there is an amide fragment attached. The nitrogen atom of the amide is connected to a specific side chain derived from (2S) -1-ethoxy-1-oxo-4-phenylbutyl-2-yl and connected to L-alanyl. Specifically, in the (2S) -1-ethoxy-1-oxo-4-phenylbutyl-2-group, the 2-position carbon is of the S configuration, and the side chain contains ethoxy, carbonyl and phenyl groups, which are connected to L-alanyl through amide bonds, and then linked to the main structure of tetrahydroisoquinoline-3-carboxylic acid. In this way, each part constructs this unique chemical structure in a specific spatial and chemical bonding manner.
    What are the physical properties of (3S) 2- {N- [ (2S) -1-ethoxy-1-oxo-4-phenylbutan-2-yl] -L-alanyl} -1,2,3, 4-tetrahydroisoquinoline-3-carboxylic acid
    (3S) - 2 - {N - [ (2S) - 1 - ethoxy - 1 - oxo - 4 - phenylbutyl - 2 - yl] - L - alanyl} - 1,2,3,4 - tetrahydroisoquinoline - 3 - carboxylic acid, this is an organic compound. Looking at its structure, it contains tetrahydroisoquinoline, amino acid residues and other structural fragments, and these structures endow it with unique physical properties.
    First, its physical state is described. Due to the certain complexity and polarity of the molecule, it may be in a solid state at room temperature and pressure. The intermolecular force is mainly van der Waals force and hydrogen bond. The former originates from the instantaneous fluctuation of the electron cloud of each atom in the molecule, and the latter is generated by the interaction of hydrogen atoms and electronegative atoms in the carboxyl group, amino group and other groups in the molecule, which prompts the molecules to closely arrange and form a solid state.
    Then again, the solubility, the molecule contains polar carboxyl groups, ethoxy groups and amide bonds, which can form hydrogen bonds with water, so it may have a certain solubility in polar solvents such as water; however, the non-polar parts such as phenyl groups in the molecule enhance its hydrophobicity, and it may also have some solubility in non-polar organic solvents such as benzene and toluene, but overall, the solubility may be better in polar solvents.
    In terms of melting boiling point, intermolecular hydrogen bonds and van der Waals forces require more energy to overcome the force to change the state of matter, so the melting boiling point is relatively high. The specific melting boiling point value needs to be accurately determined experimentally due to the complexity of the molecular structure. However, it can be inferred that simpler organic compounds should have higher melting boiling points due to their stronger intermolecular forces.
    In addition, the chiral center of the compound also affects its physical properties. Different chiral molecules may have different crystal structures and molecular stacking methods, which in turn affect the melting point, solubility and other physical properties.
    What is the preparation method of (3S) 2- {N- [ (2S) -1-ethoxy-1-oxo-4-phenylbutan-2-yl] -L-alanyl} -1,2,3, 4-tetrahydroisoquinoline-3-carboxylic acid
    To prepare (3S) - 2 - {N - [ (2S) - 1 - ethoxy - 1 - oxo - 4 - phenylbutyl - 2 - yl] - L - alanyl} -1,2,3,4 - tetrahydroisoquinoline - 3 - carboxylic acid, the following method can be used.
    First, with a suitable starting material, find that (2S) -1-ethoxy-1-oxo-4-phenylbutyl-2-yl related compounds, and L-alanine through condensation, so that the two are connected to obtain intermediates containing specific fragments. This condensation step requires the selection of appropriate reagents and reaction conditions, or the assistance of coupling agents, at a suitable temperature and pH, so that the reaction can proceed smoothly to ensure the selectivity and yield of the reaction.
    Then, this intermediate is combined with the related precursor of 1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid. The process of this binding may involve specific reaction pathways, such as nucleophilic substitution, acylation, etc., depending on the activity of the raw material and the reaction check point. During the reaction, careful temperature control and time control are required, and attention is paid to the change of the reaction system.
    Or another way can be found, first modifying 1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid, introducing suitable reactive groups, and then combining with the prepared containing (2S) -1-ethoxy-1-oxo-4-phenylbutyl-2-group and L-alanyl fragments. The key here is the precise control of each step of the reaction, from the purity of the raw material to the fine-tuning of the reaction conditions, all of which are related to the quality and yield of the final product. After each step of the reaction, it is necessary to monitor the purity and structure of the product by suitable analytical means, such as chromatography and spectroscopy, to ensure that it is correct before proceeding to the next step of the reaction, so that the required (3S) - 2 - {N - [ (2S) - 1 - ethoxy - 1 - oxo - 4 - phenylbutyl - 2 - yl] - L - alanyl} -1,2,3,4 - tetrahydroisoquinoline - 3 - carboxylic acid can be prepared.
    What are the application fields of (3S) 2- {N- [ (2S) -1-ethoxy-1-oxo-4-phenylbutan-2-yl] -L-alanyl} -1,2,3, 4-tetrahydroisoquinoline-3-carboxylic acid
    (3S) - 2 - {N - [ (2S) - 1 - ethoxy - 1 - oxo - 4 - phenylbutyl - 2 - yl] - L - alanyl} - 1,2,3,4 - tetrahydroisoquinoline - 3 - carboxylic acid, this compound is often used in the field of medicine and chemical industry.
    Guanfu Medicine, which may be a potential pharmaceutical active ingredient. The tetrahydroisoquinoline and amino acid fragments in the Gain structure can interact with specific targets in organisms. Tetrahydroisoquinoline structures have the ability to regulate the activity of neurotransmitters, or can be used in the treatment of neurological diseases, such as Parkinson's disease, by binding to nerve receptors to regulate nerve signaling. And amino acid fragments, because of their structure similar to natural amino acids, or can participate in the process of protein synthesis and metabolism, are also beneficial to the regulation of physiological functions of the body.
    In the chemical industry, this compound may be an important intermediate. With its unique structure, it can be chemically modified, derivatized and other means to prepare more complex and functional compounds. For example, by reacting its side chain or carboxyl group, material additives with special properties can be synthesized to improve the physical and chemical properties of materials, such as enhancing the stability and toughness of polymers. < Br >
    And because of its exquisite molecular structure, it has also attracted the attention of researchers in the field of organic synthetic chemistry. The synthesis process involves many organic reactions, such as condensation reactions, substitution reactions, etc., and also promotes the development and optimization of organic synthesis methods. Therefore, (3S) - 2 - {N - [ (2S) - 1 - ethoxy - 1 - oxo - 4 - phenylbutyl - 2 - yl] - L - alanyl} - 1,2,3,4 - tetrahydroisoquinoline - 3 - carboxylic acid has potential application value in many fields such as medicine, chemical industry and organic synthesis.
    What is the market outlook for (3S) 2- {N- [ (2S) -1-ethoxy-1-oxo-4-phenylbutan-2-yl] -L-alanyl} -1,2,3, 4-tetrahydroisoquinoline-3-carboxylic acid
    Today there is (3S) -2-{ N- [ (2S) -1-ethoxy-1-oxo-4-phenylbutyl-2-yl] -L-alanyl} -1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid. Its market prospect is related to many aspects, just like a merchant considering the sales and profitability of goods.
    This compound may have unique potential in the field of medicine. Today's pharmaceutical development requires the search for novel and efficient therapeutic drugs. If this acid can exhibit specific biological activities, such as the effect on key targets of certain diseases, it may become the cornerstone of new drug development. In terms of the current demand for the treatment of various diseases, if it can be confirmed to be effective for specific disease models in the laboratory research stage, it will attract the attention of pharmaceutical companies and is expected to start the journey of clinical trials.
    In terms of scientific research applications, it may be an important intermediate in organic synthetic chemistry. Chemical research is constantly pursuing new reactions and new structures. The unique chemical structure of this acid may play a key role in the synthesis of complex natural products or new functional materials. Researchers are like craftsmen seeking new materials. This acid may become a unique tool in their hands to open up new research directions.
    However, its market prospects are not entirely smooth. Synthetic cost is a key consideration. If the preparation process is complicated and the raw materials are expensive, large-scale production will be limited, and it will be difficult to circulate widely in the market. And the market competition is fierce. If a compound of the same type or with similar functions exists, it needs to show significant advantages, such as higher activity and lower toxicity.
    In short, the market prospect of (3S) -2-{ N- [ (2S) -1-ethoxy-1-oxo-4-phenylbutyl-2-yl] -L-alanyl} -1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid, opportunities and challenges coexist, and it needs to be deeply studied and explored by all parties to clarify its exact positioning and development space in the market.