structure of 3-Chloro-6-piperazinopyridazine Hydrochloride

3-Chloro-6-piperazinopyridazine Hydrochloride

CAS No.: 100241-11-0
M. Wt: 235.114
M. Fa: C8H12Cl2N4
InChI Key: NMDKBLUVQLFFOA-UHFFFAOYSA-N
Appearance: Off white solid

Names and Identifiers of 100241-11-0

CAS Number

100241-11-0

MDL Number

MFCD16620387

IUPAC Name

3-chloro-6-piperazin-1-ylpyridazine;hydrochloride

InChI

InChI=1S/C8H11ClN4.ClH/c9-7-1-2-8(12-11-7)13-5-3-10-4-6-13;/h1-2,10H,3-6H2;1H

InChIKey

NMDKBLUVQLFFOA-UHFFFAOYSA-N

Canonical SMILES

C1CN(CCN1)C2=NN=C(C=C2)Cl.Cl

UNSPSC Code

12352100

Physical and chemical properties of 100241-11-0

Exact Mass

234.043900

LogP

1.73540

Molecular Formula

C8H12Cl2N4

Molecular Weight

235.114

PSA

41.05000

Storage condition

2-8°C

Safety Information of 100241-11-0

Pictograms

Signal Word

Warning

Safety Data Sheet

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

Applications of 100241-11-0

3-Chloro-6-piperazinopyridazine Hydrochloride has several applications in various fields:

  • Pharmaceutical Development: It serves as a lead compound for developing new drugs targeting neurological disorders and cancer.
  • Research: Utilized in studies exploring receptor interactions and enzyme inhibition.
  • Chemical Synthesis: Acts as an intermediate in synthesizing other biologically active compounds or pharmaceuticals .

Interaction Studies of 100241-11-0

Interaction studies involving 3-Chloro-6-piperazinopyridazine Hydrochloride have focused on its pharmacokinetics and pharmacodynamics. It has been shown to interact with various receptors and enzymes, influencing neurotransmitter levels and potentially modulating physiological responses. Notably, it may act as a substrate for P-glycoprotein, affecting its bioavailability and distribution within biological systems .

Biological Activity of 100241-11-0

Research indicates that 3-Chloro-6-piperazinopyridazine Hydrochloride exhibits notable biological activities, particularly in the realm of pharmacology. It has been studied for its potential as an antitumor agent and possesses properties that may influence neurotransmitter systems. The compound's ability to cross the blood-brain barrier suggests its utility in treating central nervous system disorders . Furthermore, it has shown activity against certain pathogens, indicating potential applications in antimicrobial therapies .

Physical sample testing spectrum (NMR) of 100241-11-0

Physical sample testing spectrum (NMR) of 100241-11-0

Retrosynthesis analysis of 100241-11-0

  • Route#1

    Cas:110-85-0
    Cas:141-30-0
    Cas:100241-11-0
  • Route#2

    Cas:109-01-3
    Cas:141-30-0
    Cas:100241-11-0