structure of 3-bromo-7-methyl-1H-pyrrolo[3,2-c]pyridine

3-bromo-7-methyl-1H-pyrrolo[3,2-c]pyridine

CAS No.: 1000341-40-1
M. Wt: 211.059
M. Fa: C8H7BrN2
InChI Key: WKMJXOXACYHNEA-UHFFFAOYSA-N

Names and Identifiers of 1000341-40-1

CAS Number

1000341-40-1

MDL Number

MFCD09749975

IUPAC Name

3-bromo-7-methyl-1H-pyrrolo[3,2-c]pyridine

InChI

InChI=1S/C8H7BrN2/c1-5-2-10-3-6-7(9)4-11-8(5)6/h2-4,11H,1H3

InChIKey

WKMJXOXACYHNEA-UHFFFAOYSA-N

Canonical SMILES

CC1=CN=CC2=C1NC=C2Br

UNSPSC Code

12352100

Physical and chemical properties of 1000341-40-1

Boiling Point

360.0±37.0 °C at 760 mmHg

Density

1.7±0.1 g/cm3

Exact Mass

209.979248

Flash Point

171.5±26.5 °C

H Bond Acceptors

1

H Bond Donors

1

Index of Refraction

1.697

LogP

1.88

Molecular Formula

C8H7BrN2

Molecular Weight

211.059

PSA

28.68000

Vapour Pressure

0.0±0.8 mmHg at 25°C

Safety Information of 1000341-40-1

Pictograms

Signal Word

 Warning

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

Applications of 1000341-40-1

3-Bromo-7-methyl-1H-pyrrolo[3,2-c]pyridine has several potential applications:

  • Pharmaceutical Development: As a lead compound for developing new drugs targeting specific biological pathways.
  • Material Science: Its unique properties make it suitable for use in developing functional materials such as organic semiconductors or sensors.
  • Chemical Research: Used as a building block in organic synthesis to create more complex molecules with desired functionalities.

Interaction Studies of 1000341-40-1

Interaction studies involving 3-bromo-7-methyl-1H-pyrrolo[3,2-c]pyridine focus on its binding affinity and mechanism of action with various biological targets:

  • Enzyme Inhibition: Investigations into its role as an inhibitor of specific enzymes have shown promise in therapeutic contexts.
  • Receptor Binding: Studies exploring its interaction with cellular receptors contribute to understanding its pharmacological profile and potential side effects.

These studies are crucial for assessing the viability of this compound as a candidate for drug development.

Biological Activity of 1000341-40-1

Research indicates that compounds related to 3-bromo-7-methyl-1H-pyrrolo[3,2-c]pyridine exhibit various biological activities. For instance:

  • Inhibition of Colchicine-Binding Sites: Derivatives of pyrrolopyridines have been designed as inhibitors targeting colchicine-binding sites, which are relevant in cancer treatment.
  • Antimicrobial Properties: Some studies suggest that halogenated pyrrolopyridine derivatives may possess antimicrobial activity, making them candidates for further investigation in drug development.

The unique structural features of 3-bromo-7-methyl-1H-pyrrolo[3,2-c]pyridine contribute to its potential as a lead compound in pharmacological research.