structure of 5,7-Dichloro-1H-pyrrolo[2,3-C]pyridine

5,7-Dichloro-1H-pyrrolo[2,3-C]pyridine

CAS No.: 1001412-41-4
M. Wt: 187.026
M. Fa: C7H4Cl2N2
InChI Key: OALVDHPNAWHICK-UHFFFAOYSA-N
Appearance: Pale-yellow Solid

Names and Identifiers of 5,7-Dichloro-1H-pyrrolo[2,3-C]pyridine

CAS Number

1001412-41-4

MDL Number

MFCD11845567

IUPAC Name

5,7-dichloro-1H-pyrrolo[2,3-c]pyridine

InChI

InChI=1S/C7H4Cl2N2/c8-5-3-4-1-2-10-6(4)7(9)11-5/h1-3,10H

InChIKey

OALVDHPNAWHICK-UHFFFAOYSA-N

Canonical SMILES

C1=CNC2=C(N=C(C=C21)Cl)Cl

UNSPSC Code

12352100

Physical and chemical properties of 5,7-Dichloro-1H-pyrrolo[2,3-C]pyridine

Acidity coefficient

12.16±0.40(Predicted)

Boiling Point

371.6±37.0 °C at 760 mmHg

Density

1.6±0.1 g/cm3

Exact Mass

185.975159

Flash Point

210.2±12.1 °C

Index of Refraction

1.708

LogP

2.70

Molecular Formula

C7H4Cl2N2

Molecular Weight

187.026

PSA

28.68000

Storage condition

under inert gas (nitrogen or Argon) at 2-8°C

Vapour Pressure

0.0±0.8 mmHg at 25°C

Safety Information of 5,7-Dichloro-1H-pyrrolo[2,3-C]pyridine

Pictograms

Signal Word

 Warning

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

Applications of 5,7-Dichloro-1H-pyrrolo[2,3-C]pyridine

5,7-Dichloro-1H-pyrrolo[2,3-C]pyridine has several notable applications:

  • Pharmaceutical Development: Due to its kinase inhibitory properties, it is being investigated as a potential therapeutic agent for various cancers and metabolic diseases.
  • Agricultural Uses: Its fungicidal activity suggests potential applications in crop protection.
  • Chemical Synthesis: It serves as a building block for synthesizing more complex organic molecules in medicinal chemistry.

Interaction Studies of 5,7-Dichloro-1H-pyrrolo[2,3-C]pyridine

Interaction studies involving 5,7-dichloro-1H-pyrrolo[2,3-C]pyridine have focused on its binding affinity to various biological targets. Research indicates that it may act as a selective inhibitor for specific kinases involved in cancer progression. Such studies are critical for understanding its mechanism of action and optimizing its efficacy as a therapeutic agent. Additionally, investigations into its interactions with other biomolecules provide insights into potential side effects and drug-drug interactions.

Biological Activity of 5,7-Dichloro-1H-pyrrolo[2,3-C]pyridine

5,7-Dichloro-1H-pyrrolo[2,3-C]pyridine exhibits significant biological activity, particularly as an inhibitor of various kinases. Studies have indicated that compounds related to this structure can inhibit fibroblast growth factor receptors (FGFRs), which are implicated in several cancers. Furthermore, derivatives have shown potential as anti-diabetic agents and possess fungicidal properties, suggesting their applicability in both pharmaceutical and agricultural fields.

Physical sample testing spectrum (NMR) of 5,7-Dichloro-1H-pyrrolo[2,3-C]pyridine

Physical sample testing spectrum (NMR) of 5,7-Dichloro-1H-pyrrolo[2,3-C]pyridine

Retrosynthesis analysis of 5,7-Dichloro-1H-pyrrolo[2,3-C]pyridine

  • Route#1

    Cas:16013-85-7
    Cas:1001412-41-4

  • Route#2

    Cas:16013-85-7
    Cas:1826-67-1
    Cas:1001412-41-4