Cas no 90410-27-8 (2-{(4-Chlorophenyl)sulfonylamino}propanoic Acid)

2-{(4-Chlorophenyl)sulfonylamino}propanoic acid is a sulfonamide derivative with potential applications in medicinal chemistry and pharmaceutical research. This compound features a chlorophenyl sulfonyl group linked to an amino acid backbone, which may contribute to its biological activity, particularly as an enzyme inhibitor or intermediate in drug synthesis. Its structural properties, including the sulfonamide moiety and carboxylic acid functionality, make it a versatile building block for further chemical modifications. The presence of the chloro substituent enhances its stability and reactivity in synthetic pathways. This compound is typically utilized in research settings for developing novel therapeutic agents or studying structure-activity relationships. Proper handling and storage are recommended due to its reactive functional groups.
2-{(4-Chlorophenyl)sulfonylamino}propanoic Acid structure
90410-27-8 structure
Product Name:2-{(4-Chlorophenyl)sulfonylamino}propanoic Acid
CAS No:90410-27-8
MF:C9H10ClNO4S
MW:263.698000431061
MDL:MFCD00706949
CID:1075094
PubChem ID:362749
Update Time:2025-06-26

2-{(4-Chlorophenyl)sulfonylamino}propanoic Acid Chemical and Physical Properties

Names and Identifiers

    • 2-(4-Chlorophenylsulfonamido)propanoic acid
    • 2-{[(4-Chlorophenyl)sulfonyl]amino}propanoic acid
    • CBKinase1_000453
    • MFCD00706949
    • BB 0220629
    • DTXSID80327025
    • SCHEMBL3951678
    • NCI60_008567
    • HMS1539M21
    • Cambridge id 5527786
    • 2-(4-Chlorophenylsulfonamido)propanoicacid
    • NSC627005
    • EN300-06111
    • 2-[(4-chlorobenzene)sulfonamido]propanoic acid
    • 2-(4-chlorobenzenesulfonamido)propanoic acid
    • FT-0640627
    • 2-(4-Chloro-benzenesulfonylamino)-propionic acid
    • 90410-27-8
    • CHEMBL1991668
    • N-p-chlorobenzenesulfonylaminopropionic acid
    • CBKinase1_012853
    • 2-{[(4-Chlorophenyl)sulfonyl]amino}propanoic acid (Bes(4-Cl)-DL-Ala-OH)
    • N-(4-Chlorobenzene-1-sulfonyl)alanine
    • CS-0220224
    • Oprea1_680955
    • NSC-627005
    • 12G-396S
    • 2-([(4-chlorophenyl)sulfonyl]amino)propanoic acid
    • 59724-70-8
    • AKOS016040278
    • TimTec1_002045
    • Z45674769
    • SR-01000029714-1
    • Oprea1_408669
    • N-((4-CHLOROPHENYL)SULFONYL)ALANINE
    • 2-[(4-chlorophenyl)sulfonylamino]propanoic acid
    • SR-01000029714
    • AKOS000116513
    • ((4-Chlorophenyl)sulfonyl)-L-alanine
    • DB-053449
    • N-[(4-chlorophenyl)sulfonyl]-L-alanine
    • 2-{(4-Chlorophenyl)sulfonylamino}propanoic Acid
    • MDL: MFCD00706949
    • Inchi: 1S/C9H10ClNO4S/c1-6(9(12)13)11-16(14,15)8-4-2-7(10)3-5-8/h2-6,11H,1H3,(H,12,13)
    • InChI Key: SGHZTBDKKOKWDI-UHFFFAOYSA-N
    • SMILES: ClC1C=CC(=CC=1)S(NC(C(=O)O)C)(=O)=O

Computed Properties

  • Exact Mass: 263.0019067g/mol
  • Monoisotopic Mass: 263.0019067g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 4
  • Complexity: 343
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.5
  • Topological Polar Surface Area: 91.8?2

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Additional information on 2-{(4-Chlorophenyl)sulfonylamino}propanoic Acid

Comprehensive Overview of 2-{(4-Chlorophenyl)sulfonylamino}propanoic Acid (CAS No. 90410-27-8)

2-{(4-Chlorophenyl)sulfonylamino}propanoic Acid, identified by its CAS No. 90410-27-8, is a specialized organic compound that has garnered significant attention in pharmaceutical and biochemical research. This compound, often referred to as a sulfonamide derivative, is characterized by its unique molecular structure, which includes a 4-chlorophenyl group attached to a sulfonylamino moiety. Its propanoic acid backbone further enhances its reactivity and potential applications in various scientific domains.

The growing interest in 2-{(4-Chlorophenyl)sulfonylamino}propanoic Acid is partly due to its potential role in drug discovery and medicinal chemistry. Researchers are increasingly exploring its utility as a building block for synthesizing novel therapeutic agents. Its structural features make it a promising candidate for targeting enzyme inhibition, particularly in pathways related to inflammation and metabolic disorders. This aligns with current trends in personalized medicine and the search for small-molecule inhibitors with high specificity.

From a synthetic chemistry perspective, CAS No. 90410-27-8 is valued for its versatility. The compound's sulfonamide group provides a robust platform for further chemical modifications, enabling the creation of diverse analogs. This property is particularly relevant in the context of high-throughput screening and combinatorial chemistry, where researchers seek to optimize molecular properties for specific biological targets. The 4-chlorophenyl moiety also contributes to the compound's stability, a critical factor in drug formulation and delivery systems.

In addition to its pharmaceutical applications, 2-{(4-Chlorophenyl)sulfonylamino}propanoic Acid has found use in biochemical research. Its ability to interact with proteins and enzymes makes it a valuable tool for studying molecular interactions and signal transduction pathways. This is especially pertinent given the rising focus on proteomics and metabolomics, where understanding small-molecule effects on cellular processes is paramount. The compound's carboxylic acid functionality further allows for conjugation with other molecules, facilitating the development of probes and labels for imaging and diagnostic purposes.

The environmental and green chemistry aspects of CAS No. 90410-27-8 are also worth noting. As the scientific community shifts toward sustainable synthesis methods, there is increasing scrutiny on the ecological impact of chemical intermediates. 2-{(4-Chlorophenyl)sulfonylamino}propanoic Acid has been evaluated for its biodegradability and potential as a green intermediate in industrial processes. This aligns with broader initiatives to reduce carbon footprints and adopt eco-friendly alternatives in chemical manufacturing.

Another area of interest is the compound's potential in agricultural chemistry. While not a direct pesticide or herbicide, its structural motifs are being investigated for their role in designing plant growth regulators and stress-resistant crop enhancers. This application is particularly relevant in the face of climate change and the need for sustainable agriculture solutions. Researchers are exploring how derivatives of 2-{(4-Chlorophenyl)sulfonylamino}propanoic Acid can modulate plant physiology to improve yield and resilience.

From a commercial standpoint, the demand for CAS No. 90410-27-8 is driven by its niche applications in specialty chemicals and fine chemicals markets. Suppliers and manufacturers are increasingly focusing on high-purity grades of this compound to meet the stringent requirements of pharmaceutical and biotech industries. The compound's patent landscape and regulatory status are also critical considerations for stakeholders, particularly in regions with robust intellectual property protections.

In summary, 2-{(4-Chlorophenyl)sulfonylamino}propanoic Acid (CAS No. 90410-27-8) represents a multifaceted compound with broad implications across drug development, biochemical research, and industrial applications. Its unique structural attributes and reactivity profile position it as a valuable asset in modern scientific endeavors. As research continues to uncover new possibilities for this molecule, its relevance in addressing contemporary challenges in healthcare, agriculture, and sustainability is expected to grow.

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