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CS-W001157 4
Total: USD 88.00

3-bromobenzene-1-sulfonamide

  • CAS No. 89599-01-9

  • Cat. No. CS-W004130
  • Purity≥98%
  • MDL No.MFCD00084903

*For research and further manufacturing use only, not for direct human use.

3-bromobenzene-1-sulfonamide|CS-W004130

Structure of 89599-01-9

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General Information

  • CAS No. 89599-01-9
  • Cat. No. CS-W004130
  • Purity ≥98%
  • MDL No. MFCD00084903
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₆BrNO₂S
  • Molecular Weight 236.09
  • Synonym(s) 3-Bromobenzenesulfonamide
  • SMILES Brc1cccc(c1)S(=O)(=O)N

Description

3-Bromobenzene-1-sulfonamide features a bromine substituent at the meta position relative to the sulfonamide group, enabling selective functionalization in medicinal chemistry. This bench-stable derivative integrates readily into scaffold diversification campaigns, offering a platform for targeted covalent inhibition studies and structure-activity exploration in kinase and protease inhibitor development.

Application

3-Bromobenzene-1-sulfonamide serves as a versatile building block in medicinal chemistry, enabling direct incorporation of both bromine and sulfonamide functionalities into target molecules. The bromine atom facilitates subsequent cross-coupling reactions such as Suzuki-Miyaura or Stille couplings, while the sulfonamide group provides hydrogen-bonding capability and metabolic stability. Its bench-stable nature and compatibility with standard reaction conditions make it well-suited for modular synthesis of bioactive compounds and heterocyclic scaffolds.

Synthesis

  • Route1

    References

    • Justus Liebigs Annalen der Chemie, , vol. 177, p. 82

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   60.16
  • LogP   1.0965
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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