structure of 6-Chloro-3-iodo-1H-pyrrolo[3,2-c]pyridine

6-Chloro-3-iodo-1H-pyrrolo[3,2-c]pyridine

CAS No.: 1000341-55-8
M. Wt: 278.478
M. Fa: C7H4ClIN2
InChI Key: OFYFYASYSPIQPM-UHFFFAOYSA-N
Appearance: Yellow Solid

Names and Identifiers of 1000341-55-8

CAS Number

1000341-55-8

MDL Number

MFCD09749980

IUPAC Name

6-chloro-3-iodo-1H-pyrrolo[3,2-c]pyridine

InChI

InChI=1S/C7H4ClIN2/c8-7-1-6-4(2-11-7)5(9)3-10-6/h1-3,10H

InChIKey

OFYFYASYSPIQPM-UHFFFAOYSA-N

Canonical SMILES

C1=C2C(=CN=C1Cl)C(=CN2)I

UNSPSC Code

12352100

Physical and chemical properties of 1000341-55-8

Boiling Point

415.4±40.0 °C at 760 mmHg

Density

2.2±0.1 g/cm3

Exact Mass

277.910767

Flash Point

205.0±27.3 °C

Index of Refraction

1.785

LogP

2.35

Molecular Formula

C7H4ClIN2

Molecular Weight

278.478

PSA

28.68000

Storage condition

2-8°C(protect from light)

Vapour Pressure

0.0±0.9 mmHg at 25°C

Safety Information of 1000341-55-8

Pictograms

Signal Word

 Warning

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

Applications of 1000341-55-8

6-Chloro-3-iodo-1H-pyrrolo[3,2-c]pyridine has several applications:

  • Pharmaceutical Development: It serves as an intermediate in the synthesis of bioactive compounds, particularly those targeting cancer pathways.
  • Chemical Research: Its unique structure makes it a subject of study for new synthetic methodologies and reaction mechanisms.
  • Material Science: Potential applications in developing advanced materials due to its electronic properties.

Interaction Studies of 1000341-55-8

Studies involving 6-chloro-3-iodo-1H-pyrrolo[3,2-c]pyridine often focus on its interactions with biological targets. For instance:

  • Protein Binding Studies: Investigations into how this compound binds to specific proteins can reveal insights into its mechanism of action and therapeutic potential.
  • In Vivo Studies: Animal models are used to assess the pharmacokinetics and pharmacodynamics of this compound, providing data on its efficacy and safety profile.

Biological Activity of 1000341-55-8

Recent studies have indicated that compounds similar to 6-chloro-3-iodo-1H-pyrrolo[3,2-c]pyridine exhibit significant biological activities. These include potential anti-cancer properties, with some derivatives acting as inhibitors of specific protein targets involved in tumor growth. The unique halogen substitutions may enhance their interaction with biological macromolecules, making them valuable in medicinal chemistry.

Physical sample testing spectrum (NMR) of 1000341-55-8

Physical sample testing spectrum (NMR) of 1000341-55-8

Retrosynthesis analysis of 1000341-55-8

  • Route#1

    Cas:74976-31-1
    Cas:1000341-55-8