structure of 5-Chloro-6-methyl-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde

5-Chloro-6-methyl-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde

CAS No.: 1000340-13-5
M. Wt: 194.618
M. Fa: C9H7ClN2O
InChI Key: SRHIQFRRDZIXSE-UHFFFAOYSA-N

Names and Identifiers of 1000340-13-5

CAS Number

1000340-13-5

MDL Number

MFCD09880102

IUPAC Name

5-chloro-6-methyl-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde

InChI

InChI=1S/C9H7ClN2O/c1-5-8(10)2-7-6(4-13)3-11-9(7)12-5/h2-4H,1H3,(H,11,12)

InChIKey

SRHIQFRRDZIXSE-UHFFFAOYSA-N

Canonical SMILES

CC1=C(C=C2C(=CNC2=N1)C=O)Cl

UNSPSC Code

12352100

Physical and chemical properties of 1000340-13-5

Density

1.4±0.1 g/cm3

Exact Mass

194.024689

H Bond Acceptors

2

H Bond Donors

1

Index of Refraction

1.716

LogP

2.76

Molecular Formula

C9H7ClN2O

Molecular Weight

194.618

PSA

45.75000

Safety Information of 1000340-13-5

Pictograms

Signal Word

 Warning

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

Applications of 1000340-13-5

5-Chloro-6-methyl-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde has potential applications in:

  • Pharmaceuticals: As a lead compound for developing new anticancer agents targeting FGFR pathways.
  • Chemical Research: In studies focused on synthesizing novel heterocyclic compounds with varied biological activities.

The unique structure of this compound allows for modifications that can enhance its efficacy and selectivity in biological systems .

Interaction Studies of 1000340-13-5

Studies on the interactions of 5-Chloro-6-methyl-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde with biomolecules have shown that it may intercalate with DNA. This interaction is critical for understanding its mechanism of action as an antiproliferative agent. Molecular docking studies suggest that this compound binds effectively to target sites within DNA structures .

Biological Activity of 1000340-13-5

Research indicates that derivatives of 1H-pyrrolo[2,3-b]pyridines, including 5-Chloro-6-methyl-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde, exhibit notable biological activities. These compounds have been studied for their potential as inhibitors of fibroblast growth factor receptors (FGFRs), which play a crucial role in cancer progression. For instance, certain derivatives demonstrated potent inhibitory effects against FGFR1, FGFR2, and FGFR3, making them promising candidates for cancer therapy .