structure of 2-[methyl(7H-purin-6-yl)amino]acetic acid

2-[methyl(7H-purin-6-yl)amino]acetic acid

CAS No.: 1000933-27-6
M. Wt: 207.19
M. Fa: C8H9N5O2
InChI Key: ZSGVBHCWQGRFDO-UHFFFAOYSA-N

Names and Identifiers of 1000933-27-6

CAS Number

1000933-27-6

EC Number

839-387-3

MDL Number

MFCD09944032

IUPAC Name

2-[methyl(7H-purin-6-yl)amino]acetic acid

InChI

InChI=1S/C8H9N5O2/c1-13(2-5(14)15)8-6-7(10-3-9-6)11-4-12-8/h3-4H,2H2,1H3,(H,14,15)(H,9,10,11,12)

InChIKey

ZSGVBHCWQGRFDO-UHFFFAOYSA-N

Canonical SMILES

CN(CC(=O)O)C1=NC=NC2=C1NC=N2

UNSPSC Code

12352100

Physical and chemical properties of 1000933-27-6

Boiling Point

586.4±40.0 °C(Predicted)

Density

1.585±0.06 g/cm3(Predicted)

H Bond Acceptors

6

H Bond Donors

2

LogP

-1.30046573588173

Molecular Formula

C8H9N5O2

Molecular Weight

207.19

Safety Information of 1000933-27-6

Pictograms

Signal Word

 Warning

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

Applications of 1000933-27-6

[Methyl(7H-purin-6-yl)amino]acetic acid has several applications across different fields:

  • Pharmaceutical Development: It serves as a building block in the synthesis of more complex molecules with potential therapeutic effects.
  • Biochemical Research: The compound is studied for its role in metabolic pathways and enzyme interactions, contributing to our understanding of cellular processes.
  • Agricultural Chemistry: It may be explored for its potential use in developing plant growth regulators based on its biochemical properties.

Interaction Studies of 1000933-27-6

Research into the interactions of [methyl(7H-purin-6-yl)amino]acetic acid with biological targets is crucial for understanding its mechanism of action. Studies have focused on:

  • Enzyme Inhibition: Investigating how this compound affects enzymes involved in nucleotide metabolism can reveal its potential therapeutic applications.
  • Receptor Binding: Analyzing its affinity for specific receptors may provide insights into its role in signaling pathways and biological responses.

Biological Activity of 1000933-27-6

The biological activity of [methyl(7H-purin-6-yl)amino]acetic acid is primarily linked to its role in nucleic acid metabolism. Compounds derived from purines are known to influence various biological processes, including:

  • Anticancer Activity: Research has indicated that purine derivatives may exhibit cytotoxic effects against cancer cells, making them potential candidates for anticancer therapies.
  • Enzyme Interaction: This compound may interact with specific enzymes involved in nucleotide synthesis or metabolism, potentially inhibiting their activity and affecting cellular processes.
  • Neuroprotective Effects: Some studies suggest that purine derivatives can have neuroprotective properties, possibly through modulation of signaling pathways related to neuronal survival.