Cas no 477723-14-1 (Benzenesulfonamide, N-cyclobutyl-4-nitro-)

Benzenesulfonamide, N-cyclobutyl-4-nitro-, is a nitro-substituted sulfonamide derivative characterized by its cyclobutyl functional group. This compound is of interest in synthetic organic chemistry and pharmaceutical research due to its potential as an intermediate in the development of bioactive molecules. The presence of the nitro group enhances reactivity, facilitating further functionalization, while the cyclobutyl moiety may contribute to steric and electronic effects in molecular interactions. Its well-defined structure and purity make it suitable for use in method development, structure-activity studies, and as a building block for more complex sulfonamide-based compounds. Proper handling is advised due to potential sensitivity to light and heat.
Benzenesulfonamide, N-cyclobutyl-4-nitro- structure
477723-14-1 structure
Product Name:Benzenesulfonamide, N-cyclobutyl-4-nitro-
CAS No:477723-14-1
MF:C10H12N2O4S
MW:256.278281211853
CID:2646736
PubChem ID:22326749
Update Time:2025-06-08

Benzenesulfonamide, N-cyclobutyl-4-nitro- Chemical and Physical Properties

Names and Identifiers

    • SCHEMBL5723140
    • Benzenesulfonamide,N-cyclobutyl-4-nitro-
    • 477723-14-1
    • 4-(N-Cyclobutylsulphamoyl)nitrobenzene
    • F52749
    • N-cyclobutyl-4-nitro-benzenesulfonamide
    • Benzenesulfonamide, N-cyclobutyl-4-nitro-
    • AIBXLIOMPXJXIV-UHFFFAOYSA-N
    • Inchi: 1S/C10H12N2O4S/c13-12(14)9-4-6-10(7-5-9)17(15,16)11-8-2-1-3-8/h4-8,11H,1-3H2
    • InChI Key: AIBXLIOMPXJXIV-UHFFFAOYSA-N
    • SMILES: S(C1C=CC(=CC=1)[N+](=O)[O-])(NC1CCC1)(=O)=O

Computed Properties

  • Exact Mass: 256.05177804Da
  • Monoisotopic Mass: 256.05177804Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 3
  • Complexity: 372
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.6
  • Topological Polar Surface Area: 100?2

Benzenesulfonamide, N-cyclobutyl-4-nitro- Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
SHANG HAI HAO HONG Biomedical Technology Co., Ltd.
1736531-1g
n-Cyclobutyl-4-nitrobenzenesulfonamide
477723-14-1 98%
1g
¥4645.00 2024-05-12

Benzenesulfonamide, N-cyclobutyl-4-nitro- Related Literature

Additional information on Benzenesulfonamide, N-cyclobutyl-4-nitro-

Benzenesulfonamide, N-cyclobutyl-4-nitro-

The compound with CAS No 477723-14-1, commonly referred to as Benzenesulfonamide, N-cyclobutyl-4-nitro-, is a significant molecule in the field of organic chemistry and pharmaceutical research. This compound has garnered attention due to its unique structural properties and potential applications in drug development. The benzenesulfonamide core of the molecule provides a stable framework, while the N-cyclobutyl and 4-nitro substituents introduce functional groups that enhance its reactivity and bioavailability.

Recent studies have highlighted the importance of benzenesulfonamides in medicinal chemistry, particularly as they serve as scaffolds for various bioactive compounds. The N-cyclobutyl group in this compound contributes to its lipophilicity, which is crucial for crossing biological membranes and interacting with target proteins. Additionally, the 4-nitro substituent introduces electron-withdrawing effects, which can modulate the electronic properties of the molecule, making it more suitable for specific biological interactions.

One of the most promising applications of Benzenesulfonamide, N-cyclobutyl-4-nitro- lies in its potential as a lead compound for anti-inflammatory and analgesic agents. Researchers have explored its ability to inhibit key enzymes involved in inflammatory pathways, such as cyclooxygenase (COX) and lipoxygenase (LOX). The compound's unique structure allows it to bind effectively to these enzyme targets, demonstrating potent anti-inflammatory activity in preclinical models.

Furthermore, the N-cyclobutyl group has been shown to enhance the compound's stability under physiological conditions, reducing its susceptibility to metabolic degradation. This property is essential for ensuring that the compound remains active in the body for an extended period, thereby improving therapeutic efficacy. The combination of these features makes Benzenesulfonamide, N-cyclobutyl-4-nitro- a valuable candidate for further drug development studies.

In terms of synthesis, the compound can be prepared through a multi-step process involving nucleophilic substitution and nitration reactions. The use of advanced synthetic techniques has enabled researchers to optimize the yield and purity of the compound, ensuring its suitability for both analytical and pharmacological studies.

Recent advancements in computational chemistry have also provided deeper insights into the molecular interactions of Benzenesulfonamide, N-cyclobutyl-4-nitro-. Molecular docking studies have revealed that the compound exhibits strong binding affinities with several drug targets, including G-protein coupled receptors (GPCRs) and kinase enzymes. These findings underscore its potential as a versatile tool in drug discovery research.

In conclusion, Benzenesulfonamide, N-cyclobutyl-4-nitro- (CAS No 477723-14-1) is a compelling molecule with a wealth of opportunities in pharmaceutical research. Its unique structure, combined with favorable pharmacokinetic properties and potent biological activity, positions it as a promising lead compound for developing novel therapeutic agents.

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