structure of 1,3-Bis(3-aminophenoxy)-5-chlorobenzene Dihydrochloride

1,3-Bis(3-aminophenoxy)-5-chlorobenzene Dihydrochloride

CAS No.: 99503-73-8
M. Wt: 399.69900
M. Fa: C18H17Cl3N2O2
InChI Key: YZUFDVOYHZOIGU-UHFFFAOYSA-N
Appearance: White to Almost white powder to crystal

Names and Identifiers of 99503-73-8

CAS Number

99503-73-8

IUPAC Name

3-[3-(3-aminophenoxy)-5-chlorophenoxy]aniline;dihydrochloride

InChI

InChI=1S/C18H15ClN2O2.2ClH/c19-12-7-17(22-15-5-1-3-13(20)9-15)11-18(8-12)23-16-6-2-4-14(21)10-16;;/h1-11H,20-21H2;2*1H

InChIKey

YZUFDVOYHZOIGU-UHFFFAOYSA-N

Canonical SMILES

C1=CC(=CC(=C1)OC2=CC(=CC(=C2)Cl)OC3=CC=CC(=C3)N)N.Cl.Cl

Physical and chemical properties of 99503-73-8

Exact Mass

398.03600

LogP

7.85540

Molecular Formula

C18H17Cl3N2O2

Molecular Weight

399.69900

PSA

70.50000

Applications of 99503-73-8

1,3-Bis(3-aminophenoxy)-5-chlorobenzene dihydrochloride finds applications in various fields:

  • Research: Used as a biochemical reagent in proteomics and molecular biology studies.
  • Pharmaceutical Development: Investigated for potential therapeutic uses due to its biological activity.
  • Chemical Synthesis: Acts as an intermediate for synthesizing more complex organic compounds.

Interaction Studies of 99503-73-8

Studies on the interactions of 1,3-bis(3-aminophenoxy)-5-chlorobenzene dihydrochloride with biological systems have highlighted:

  • Protein Binding: Research indicates that this compound may bind to specific proteins, influencing their function and stability.
  • Cellular Uptake: Investigations into how this compound is taken up by cells can provide insights into its mechanism of action and potential therapeutic effects.

Biological Activity of 99503-73-8

1,3-Bis(3-aminophenoxy)-5-chlorobenzene dihydrochloride has been studied for its potential biological activities, particularly in proteomics research. It may exhibit:

  • Antimicrobial Properties: Similar compounds have shown effectiveness against various bacterial strains.
  • Anticancer Activity: Preliminary studies suggest potential applications in cancer treatment due to its ability to interact with specific cellular targets.
  • Enzyme Inhibition: The compound may inhibit certain enzymes, impacting metabolic pathways in organisms.

Physical sample testing spectrum (NMR) of 99503-73-8

Physical sample testing spectrum (NMR) of 99503-73-8