structure of 6-Bromo-7-methyl-1H-indazole-3-carbaldehyde

6-Bromo-7-methyl-1H-indazole-3-carbaldehyde

CAS No.: 1000340-73-7
M. Wt: 239.069
M. Fa: C9H7BrN2O
InChI Key: IBWRVJFENOQITQ-UHFFFAOYSA-N

Names and Identifiers of 1000340-73-7

CAS Number

1000340-73-7

EC Number

816-923-4

MDL Number

MFCD30365290

IUPAC Name

6-bromo-7-methyl-2H-indazole-3-carbaldehyde

InChI

InChI=1S/C9H7BrN2O/c1-5-7(10)3-2-6-8(4-13)11-12-9(5)6/h2-4H,1H3,(H,11,12)

InChIKey

IBWRVJFENOQITQ-UHFFFAOYSA-N

Canonical SMILES

CC1=C(C=CC2=C(NN=C12)C=O)Br

UNSPSC Code

12352100

Physical and chemical properties of 1000340-73-7

Boiling Point

420.0±40.0 °C at 760 mmHg

Density

1.7±0.1 g/cm3

Exact Mass

237.974167

Flash Point

207.8±27.3 °C

H Bond Acceptors

2

H Bond Donors

1

Index of Refraction

1.736

LogP

2.27

Molecular Formula

C9H7BrN2O

Molecular Weight

239.069

PSA

45.75000

Vapour Pressure

0.0±1.0 mmHg at 25°C

Safety Information of 1000340-73-7

Pictograms

Signal Word

Warning

Safety Data Sheet

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

Applications of 1000340-73-7

6-Bromo-7-methyl-1H-indazole-3-carbaldehyde has several applications across different fields:

  • Chemistry: It serves as a building block for the synthesis of more complex molecules and heterocyclic compounds.
  • Biology: The compound is used in the study of enzyme inhibitors and receptor modulators.
  • Pharmaceutical Industry: It has potential therapeutic applications due to its biological activity against cancer cells and other diseases.
  • Material Science: Its unique properties make it useful in the development of new materials and chemical processes.

Interaction Studies of 1000340-73-7

Research continues to explore the interactions of 6-Bromo-7-methyl-1H-indazole-3-carbaldehyde with various biological targets. Studies have indicated that it can bind to specific enzymes or receptors, modulating their activity. For example, it may act as an inhibitor of certain kinases involved in cell signaling pathways. Further investigation into these interactions is essential to fully understand its biological implications and therapeutic potential.

Similar Compounds

Several compounds share structural similarities with 6-Bromo-7-methyl-1H-indazole-3-carbaldehyde. Notable examples include:

Compound NameStructural Features
6-Bromo-1H-indazole-4-carboxaldehydeLacks the methyl group at the 7-position
4-Bromo-7-methyl-1H-indazole-3-carbaldehydeContains a bromine atom at position 4
7-Methyl-1H-indazole-3-carbaldehydeLacks the bromine atom
4-Chloro-7-methyl-1H-indazole-3-carbaldehydeContains a chlorine atom instead of bromine

Biological Activity of 1000340-73-7

The biological activity of 6-Bromo-7-methyl-1H-indazole-3-carbaldehyde is significant due to its interaction with various biomolecules. It has been shown to act as an inhibitor or activator of specific enzymes, particularly protein kinases, which play crucial roles in cellular signaling and regulation. Indazole derivatives, including this compound, have been explored for their anticancer properties by inducing apoptosis in cancer cells through specific signaling pathways. Furthermore, it may influence cell function by altering gene expression and cellular metabolism.

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