structure of 2-(N-methyl4-cyanobenzenesulfonamido)acetic acid

2-(N-methyl4-cyanobenzenesulfonamido)acetic acid

CAS No.: 1000931-40-7
M. Wt: 254.26
M. Fa: C10H10N2O4S
InChI Key: HVUMOKARPXYYFN-UHFFFAOYSA-N

Names and Identifiers of 1000931-40-7

CAS Number

1000931-40-7

IUPAC Name

2-[(4-cyanophenyl)sulfonyl-methylamino]acetic acid

InChI

InChI=1S/C10H10N2O4S/c1-12(7-10(13)14)17(15,16)9-4-2-8(6-11)3-5-9/h2-5H,7H2,1H3,(H,13,14)

InChIKey

HVUMOKARPXYYFN-UHFFFAOYSA-N

Canonical SMILES

CN(CC(=O)O)S(=O)(=O)C1=CC=C(C=C1)C#N

Physical and chemical properties of 1000931-40-7

Molecular Formula

C10H10N2O4S

Molecular Weight

254.26

Applications of 1000931-40-7

The applications of 2-(N-methyl4-cyanobenzenesulfonamido)acetic acid span several fields:

  • Pharmaceuticals: Due to its antimicrobial properties, it may be explored as a lead compound for developing new antibiotics.
  • Biochemical Research: This compound can serve as a tool in biochemical studies related to enzyme inhibition and metabolic pathways involving sulfonamides.
  • Agricultural Chemistry: Its potential use as a pesticide or herbicide could be investigated due to its biological activity against microorganisms.

These applications underscore its significance in both medicinal chemistry and agricultural sciences.

Interaction Studies of 1000931-40-7

Interaction studies involving 2-(N-methyl4-cyanobenzenesulfonamido)acetic acid focus on its binding affinity to various biological targets, particularly enzymes involved in folate metabolism. Preliminary studies suggest that this compound may exhibit competitive inhibition against dihydropteroate synthase, an enzyme critical for bacterial folate synthesis. Further pharmacological studies are required to elucidate its interactions with other biomolecules and assess its therapeutic potential.