structure of Methyl 2-[2-thiazolin-2-ylthio]acetate

Methyl 2-[2-thiazolin-2-ylthio]acetate

CAS No.: 22623-64-9
M. Wt: 191.27100
M. Fa: C6H9NO2S2
InChI Key: SNDXDCSLMVEGHZ-UHFFFAOYSA-N

Names and Identifiers of Methyl 2-[2-thiazolin-2-ylthio]acetate

CAS Number

22623-64-9

IUPAC Name

methyl 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)acetate

InChI

InChI=1S/C6H9NO2S2/c1-9-5(8)4-11-6-7-2-3-10-6/h2-4H2,1H3

InChIKey

SNDXDCSLMVEGHZ-UHFFFAOYSA-N

Canonical SMILES

COC(=O)CSC1=NCCS1

Physical and chemical properties of Methyl 2-[2-thiazolin-2-ylthio]acetate

Exact Mass

191.00700

LogP

0.43100

Molecular Formula

C6H9NO2S2

Molecular Weight

191.27100

PSA

89.26000

Applications of Methyl 2-[2-thiazolin-2-ylthio]acetate

Methyl 2-[2-thiazolin-2-ylthio]acetate has several promising applications:

  • Pharmaceuticals: Its antimicrobial and anti-inflammatory properties make it a candidate for drug development.
  • Agricultural Chemicals: It can be utilized as a biocide or fungicide due to its biological activity against pathogens.
  • Chemical Synthesis: The compound serves as an important building block in organic synthesis for creating more complex thiazole derivatives.

Interaction Studies of Methyl 2-[2-thiazolin-2-ylthio]acetate

Studies on the interactions of methyl 2-[2-thiazolin-2-ylthio]acetate with biological targets are ongoing. Initial findings suggest that it may interact with specific enzymes involved in inflammatory responses, potentially inhibiting their activity and leading to reduced inflammation. Further research is needed to elucidate its precise mechanisms of action and identify other molecular targets.

Biological Activity of Methyl 2-[2-thiazolin-2-ylthio]acetate

Research indicates that methyl 2-[2-thiazolin-2-ylthio]acetate exhibits significant biological activity. It has been investigated for:

  • Antimicrobial Properties: The compound shows potential against various bacterial strains, making it a candidate for developing new antibiotics.
  • Antifungal Activity: Its efficacy against fungal pathogens has also been noted, suggesting applications in agriculture or medicine.
  • Anti-inflammatory Effects: Preliminary studies indicate that it may modulate inflammatory pathways, offering potential as an anti-inflammatory agent.

Retrosynthesis analysis of Methyl 2-[2-thiazolin-2-ylthio]acetate

  • Route#1

    Cas:63987-96-2
    Cas:96-32-2
    Cas:22623-64-9
  • Route#2

    Cas:96-32-2
    Cas:22623-64-9
  • Route#3

    Cas:96-32-2
    Cas:96-53-7
    Cas:22623-64-9