7-Chloro-4-piperazinoquinoline - CAS 837-52-5

Name: 7-Chloro-4-piperazinoquinoline
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB037088
Product Name:	7-Chloro-4-piperazinoquinoline
CAS:	837-52-5
Synonyms:	7-chloro-4-(1-piperazinyl)quinoline; 7-chloro-4-piperazin-1-ylquinoline

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	7-chloro-4-piperazin-1-ylquinoline
Description:	An impurity of Piperaquine which is a bisquinoline antimalarial drug used in the treatment of malaria-infected patients.
Molecular Weight:	247.72
Molecular Formula:	C13H14ClN3
Canonical SMILES:	C1CN(CCN1)C2=C3C=CC(=CC3=NC=C2)Cl
InChI:	InChI=1S/C13H14ClN3/c14-10-1-2-11-12(9-10)16-4-3-13(11)17-7-5-15-6-8-17/h1-4,9,15H,5-8H2
InChI Key:	DNXNPMDUDGUXOB-UHFFFAOYSA-N
Boiling Point:	433.5 °C at 760 mmHg
Purity:	98 %
Density:	1.257 g/cm³
LogP:	2.69160

Related Products

Online Inquiry

Name:

* Phone:

* Service & Products of Interested:

Project Description:

* Quantity:

* Email:

* Verification Code:

Customer Support

If the product you need is not in our catalog, please contact us in time to submit your needs. You can help our website get better and better. Why not submit the request today?

Submit Requirement

Customer Centered

Global Delivery

Warehouses in multiple cities to ensure fast delivery

Quality Assurance

Strict process parameter control to ensure product quality

Large Stock

> 20,000 building blocks and intermediates from stock

Process Scale-up

Process scale-up from lab to industrial scale

Flexible Batch Size

Flexible batch size for diverse industrial demands

Related Functional Groups

Piperazines

[5896-75-3]C20H25N3O3
(Z)-N-(4-Phenylpiperazin-1-yl)-1-(2,3,4-trimethoxyphenyl)methanimine
[55276-43-2]C5H12N2O2S
1-Methanesulfonylpiperazine
[1191255-65-8]C11H19F3N2O2
Ethyl [4-(3,3,3-trifluoropropyl)piperazin-1-yl]acetate
[120-43-4]C7H14N2O2
Ethyl 1-piperazinecarboxylate
[104481-24-5]C10H15N3O2S
Ethyl 2-piperazin-1-yl-thiazole-4-carboxylate
[1423024-26-3]C6H17Cl3N6
N''-(piperazine-1-carboximidoyl)guanidine trihydrochloride

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
KR-20210057680-A	Novel quinoline compounds and uses thereof	20191111
WO-2021096335-A1	Novel quinoline compound and use thereof	20191111
CN-109970639-A	The method of piperaquine intermediate is synthesized in a kind of continuous current micro-reactor	20181123
WO-2019243971-A1	Novel compounds and their methods of use thereof	20180617
CN-110606830-A	Method for producing piperaquine phosphate intermediate quinoline piperazine hydrochloride by applying piperazine	20180614

PMID	Publication Date	Title	Journal
24454993	20131010	Discovery of β2 Adrenergic Receptor Ligands Using Biosensor Fragment Screening of Tagged Wild-Type Receptor	ACS medicinal chemistry letters
22590368	20120501	7-Chloro-4-(piperazin-1-yl)quinoline	Acta crystallographica. Section E, Structure reports online
21500839	20110526	Enone- and chalcone-chloroquinoline hybrid analogues: in silico guided design, synthesis, antiplasmodial activity, in vitro metabolism, and mechanistic studies	Journal of medicinal chemistry
21489789	20110515	Antiplasmodial and antitumor activity of dihydroartemisinin analogs derived via the aza-Michael addition reaction	Bioorganic & medicinal chemistry letters
20466465	20100801	Quinolines and structurally related heterocycles as antimalarials	European journal of medicinal chemistry

Complexity:	255
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	247.0876252
Formal Charge:	0
Heavy Atom Count:	17
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	247.0876252
Rotatable Bond Count:	1
Topological Polar Surface Area:	28.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.4