structure of 1-(7-Bromo-5-chloro-1H-indol-1-yl)ethanone

1-(7-Bromo-5-chloro-1H-indol-1-yl)ethanone

CAS No.: 1000343-26-9
M. Wt: 272.526
M. Fa: C10H7BrClNO
InChI Key: RWFUEEUCTCXQFE-UHFFFAOYSA-N

Names and Identifiers of 1000343-26-9

CAS Number

1000343-26-9

IUPAC Name

1-(7-bromo-5-chloroindol-1-yl)ethanone

InChI

InChI=1S/C10H7BrClNO/c1-6(14)13-3-2-7-4-8(12)5-9(11)10(7)13/h2-5H,1H3

InChIKey

RWFUEEUCTCXQFE-UHFFFAOYSA-N

Canonical SMILES

CC(=O)N1C=CC2=CC(=CC(=C21)Br)Cl

Physical and chemical properties of 1000343-26-9

Boiling Point

350.1±22.0 °C at 760 mmHg

Density

1.6±0.1 g/cm3

Exact Mass

270.939941

Flash Point

165.6±22.3 °C

Index of Refraction

1.649

LogP

3.50

Molecular Formula

C10H7BrClNO

Molecular Weight

272.526

PSA

22.00000

Vapour Pressure

0.0±0.8 mmHg at 25°C

Applications of 1000343-26-9

This compound has potential applications in various fields:

  • Medicinal Chemistry: Due to its biological activity, it may serve as a lead compound for developing new anticancer agents.
  • Chemical Research: It can be used as a building block in organic synthesis, particularly in the preparation of more complex indole derivatives.

Interaction Studies of 1000343-26-9

Studies have shown that 1-(7-Bromo-5-chloro-1H-indol-1-yl)ethanone interacts with several biomolecules. Its ability to bind selectively to specific enzymes or receptors suggests potential therapeutic applications. Understanding these interactions at the molecular level is crucial for developing targeted therapies.

Biological Activity of 1000343-26-9

Indole derivatives, including 1-(7-Bromo-5-chloro-1H-indol-1-yl)ethanone, have been shown to exhibit various biological activities. They are known to interact with multiple enzymes and proteins, influencing cellular processes such as proliferation and apoptosis. Specifically, this compound may inhibit certain enzymes involved in cancer cell growth, making it a candidate for further research in anticancer therapies.