Cas no 1065074-37-4 (1-(4-Bromo-3-trifluoromethylphenylsulfonyl)piperidine)

1-(4-Bromo-3-trifluoromethylphenylsulfonyl)piperidine structure
1065074-37-4 structure
Product Name:1-(4-Bromo-3-trifluoromethylphenylsulfonyl)piperidine
CAS No:1065074-37-4
MF:C12H13BrF3NO2S
MW:372.201331853867
MDL:MFCD11053849
CID:857324
PubChem ID:46738963
Update Time:2025-07-18

1-(4-Bromo-3-trifluoromethylphenylsulfonyl)piperidine Chemical and Physical Properties

Names and Identifiers

    • 1-((4-Bromo-3-(trifluoromethyl)phenyl)sulfonyl)piperidine
    • 1-(4-Bromo-3-trifluoromethylphenylsulfonyl)piperidine
    • 1-((4-Bromo-3-(trifluoromethyl)-phenyl)sulfonyl)piperidine
    • 1-(4-Bromo-3-(trifluoromethyl)phenylsulfonyl)piperidine
    • 1-[4-bromo-3-(trifluoromethyl)phenyl]sulfonylpiperidine
    • AKOS015835230
    • DTXSID20674606
    • 1-[4-Bromo-3-(trifluoromethyl)benzene-1-sulfonyl]piperidine
    • 1065074-37-4
    • HVQPWCCSTIBZKF-UHFFFAOYSA-N
    • CS-0207790
    • MFCD11053849
    • BS-25722
    • E84127
    • 1-[4-BROMO-3-(TRIFLUOROMETHYL)BENZENESULFONYL]PIPERIDINE
    • MDL: MFCD11053849
    • Inchi: 1S/C12H13BrF3NO2S/c13-11-5-4-9(8-10(11)12(14,15)16)20(18,19)17-6-2-1-3-7-17/h4-5,8H,1-3,6-7H2
    • InChI Key: HVQPWCCSTIBZKF-UHFFFAOYSA-N
    • SMILES: BrC1C=CC(=CC=1C(F)(F)F)S(N1CCCCC1)(=O)=O

Computed Properties

  • Exact Mass: 370.98000
  • Monoisotopic Mass: 370.98025g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 3
  • Complexity: 429
  • 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: 3.5
  • Topological Polar Surface Area: 45.8?2

Experimental Properties

  • Density: 1.587±0.06 g/cm3 (20 oC 760 Torr),
  • Solubility: Almost insoluble (0.023 g/l) (25 o C),
  • PSA: 45.76000
  • LogP: 4.66120

1-(4-Bromo-3-trifluoromethylphenylsulfonyl)piperidine Customs Data

  • HS CODE:2933399090
  • Customs Data:

    China Customs Code:

    2933399090

    Overview:

    2933399090. Other compounds with non fused pyridine rings in structure. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

1-(4-Bromo-3-trifluoromethylphenylsulfonyl)piperidine Pricemore >>

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Additional information on 1-(4-Bromo-3-trifluoromethylphenylsulfonyl)piperidine

Research Briefing on 1-(4-Bromo-3-trifluoromethylphenylsulfonyl)piperidine (CAS: 1065074-37-4)

1-(4-Bromo-3-trifluoromethylphenylsulfonyl)piperidine (CAS: 1065074-37-4) is a specialized sulfonamide derivative that has garnered significant attention in recent chemical and pharmaceutical research. This compound, characterized by its bromo- and trifluoromethyl-substituted phenyl ring linked to a piperidine moiety via a sulfonyl group, exhibits unique physicochemical properties that make it a promising candidate for various applications, including drug discovery and medicinal chemistry.

Recent studies have focused on the synthesis and optimization of 1-(4-Bromo-3-trifluoromethylphenylsulfonyl)piperidine, leveraging its structural features to explore its potential as a building block for bioactive molecules. The trifluoromethyl group, in particular, is known to enhance metabolic stability and lipophilicity, which are critical factors in drug design. Researchers have employed advanced synthetic methodologies, such as palladium-catalyzed cross-coupling reactions, to functionalize this compound further and diversify its applications.

In the context of drug discovery, 1-(4-Bromo-3-trifluoromethylphenylsulfonyl)piperidine has been investigated as a key intermediate in the development of kinase inhibitors and other targeted therapies. Preliminary in vitro studies suggest that derivatives of this compound exhibit inhibitory activity against specific protein kinases, which are implicated in various cancers and inflammatory diseases. These findings underscore the compound's potential as a scaffold for designing novel therapeutic agents.

Beyond its pharmacological applications, 1-(4-Bromo-3-trifluoromethylphenylsulfonyl)piperidine has also been explored in material science. Its robust chemical structure and stability make it suitable for use in the synthesis of advanced polymers and coatings. Researchers have reported its incorporation into polymeric matrices to enhance thermal and chemical resistance, opening new avenues for industrial applications.

Despite these promising developments, challenges remain in the large-scale synthesis and purification of 1-(4-Bromo-3-trifluoromethylphenylsulfonyl)piperidine. Recent efforts have focused on optimizing reaction conditions to improve yield and reduce byproduct formation. Additionally, computational studies have been employed to predict the compound's reactivity and interactions with biological targets, providing valuable insights for future research.

In conclusion, 1-(4-Bromo-3-trifluoromethylphenylsulfonyl)piperidine (CAS: 1065074-37-4) represents a versatile and valuable compound in the fields of medicinal chemistry and material science. Ongoing research aims to further elucidate its potential applications and address existing challenges in its synthesis and utilization. As the scientific community continues to explore this compound, it is expected to play an increasingly important role in the development of next-generation therapeutics and materials.

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