structure of 2-Iodo-4-methylthiopyrimidine

2-Iodo-4-methylthiopyrimidine

CAS No.: 1000576-08-8
M. Wt: 252.07600
M. Fa: C5H5IN2S
InChI Key: GBBQPKKFWLPCFM-UHFFFAOYSA-N

Names and Identifiers of 2-Iodo-4-methylthiopyrimidine

CAS Number

1000576-08-8

EC Number

825-778-6

IUPAC Name

2-iodo-4-methylsulfanylpyrimidine

InChI

InChI=1S/C5H5IN2S/c1-9-4-2-3-7-5(6)8-4/h2-3H,1H3

InChIKey

GBBQPKKFWLPCFM-UHFFFAOYSA-N

Canonical SMILES

CSC1=NC(=NC=C1)I

Physical and chemical properties of 2-Iodo-4-methylthiopyrimidine

Exact Mass

251.92200

LogP

1.80310

Molecular Formula

C5H5IN2S

Molecular Weight

252.07600

PSA

51.08000

Safety Information of 2-Iodo-4-methylthiopyrimidine

Pictograms

Signal Word

 Warning

Safety Data Sheet
Supports customized editing of SDS information and downloading in PDF documents.

Applications of 2-Iodo-4-methylthiopyrimidine

2-Iodo-4-methylthiopyrimidine has potential applications in several fields:

  • Medicinal Chemistry: Its derivatives may serve as lead compounds in the development of new pharmaceuticals targeting infections or cancer.
  • Agricultural Science: Compounds with similar structures are often evaluated for their herbicidal or fungicidal properties, indicating potential utility in crop protection.
  • Chemical Biology: It may be used as a biochemical probe in proteomics research due to its unique reactivity.

Interaction Studies of 2-Iodo-4-methylthiopyrimidine

Interaction studies involving 2-iodo-4-methylthiopyrimidine focus on its binding affinity to various biological targets. Preliminary studies suggest that compounds with similar structures can interact with enzymes or receptors involved in metabolic pathways, potentially leading to therapeutic effects. Further investigations are necessary to elucidate the specific interactions and mechanisms of action.

Biological Activity of 2-Iodo-4-methylthiopyrimidine

The biological activity of 2-iodo-4-methylthiopyrimidine has been explored in various contexts. Compounds with similar structures have shown antimicrobial and antiviral properties, making them candidates for pharmaceutical development. The methylthio group is often associated with enhanced biological activity compared to unsubstituted pyrimidines, suggesting that 2-iodo-4-methylthiopyrimidine may exhibit similar or improved efficacy against certain pathogens.