structure of 4-Methyl-1H-pyrrolo[3,2-c]pyridine-3-carbaldehyde

4-Methyl-1H-pyrrolo[3,2-c]pyridine-3-carbaldehyde

CAS No.: 1000342-69-7
M. Wt: 160.173
M. Fa: C9H8N2O
InChI Key: KKJQTBKKEANCCA-UHFFFAOYSA-N

Names and Identifiers of 1000342-69-7

CAS Number

1000342-69-7

IUPAC Name

4-methyl-1H-pyrrolo[3,2-c]pyridine-3-carbaldehyde

InChI

InChI=1S/C9H8N2O/c1-6-9-7(5-12)4-11-8(9)2-3-10-6/h2-5,11H,1H3

InChIKey

KKJQTBKKEANCCA-UHFFFAOYSA-N

Canonical SMILES

CC1=NC=CC2=C1C(=CN2)C=O

Physical and chemical properties of 1000342-69-7

Acidity coefficient

14.06±0.40(Predicted)

Boiling Point

368.6±37.0 °C at 760 mmHg

Density

1.3±0.1 g/cm3

Exact Mass

160.063660

Flash Point

180.3±32.9 °C

Index of Refraction

1.712

LogP

0.65

Molecular Formula

C9H8N2O

Molecular Weight

160.173

PSA

45.75000

Vapour Pressure

0.0±0.8 mmHg at 25°C

Safety Information of 1000342-69-7

Pictograms

Signal Word

 Warning

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

Applications of 1000342-69-7

4-Methyl-1H-pyrrolo[3,2-c]pyridine-3-carbaldehyde has several applications in various fields:

  • Medicinal Chemistry: Due to its biological activity, it is explored as a lead compound for developing new pharmaceuticals targeting cancer and inflammatory diseases.
  • Organic Synthesis: It serves as an intermediate in synthesizing more complex organic molecules and pharmaceuticals.
  • Chemical Research: The compound is utilized in studies investigating heterocyclic chemistry and reaction mechanisms.

These applications underline its significance in both academic research and industrial contexts.

Interaction Studies of 1000342-69-7

Interaction studies involving 4-Methyl-1H-pyrrolo[3,2-c]pyridine-3-carbaldehyde focus on its binding affinity to various biological targets. Research indicates that it may interact with specific enzymes or receptors related to cancer pathways. These interactions are critical for understanding its mechanism of action and potential therapeutic uses. Further studies are necessary to map out these interactions comprehensively and assess their implications for drug development.

Biological Activity of 1000342-69-7

Research indicates that 4-Methyl-1H-pyrrolo[3,2-c]pyridine-3-carbaldehyde exhibits notable biological activities. It has been studied for its potential as an anti-cancer agent due to its ability to inhibit specific enzymes involved in cancer cell proliferation. Additionally, preliminary studies suggest that it may possess anti-inflammatory and antimicrobial properties, although further research is needed to fully elucidate its mechanisms of action and therapeutic potential.