ChemicalBook--->CAS DataBase List--->5428-61-5

5428-61-5

5428-61-5 Structure

5428-61-5 Structure
IdentificationBack Directory
[Name]

Chloroquine Related CoMpound E
[CAS]

5428-61-5
[Synonyms]

Chloroquine Impurity
Chloroquine USP RC E
Chloroquine Impurity 3
Chloroquine Related CoMpound E
Chloroquine USP Related Compound E
N4-(5-chloroquinolin-4-yl)-N1,N1-diethylpentane-1,4-diamine
N4-(5-Chloro-4-quinolinyl)-N1,N1-diethyl-1,4-pentanediamine
1,4-Pentanediamine, N4-(5-chloro-4-quinolinyl)-N1,N1-diethyl-
N4-(5-Chloroquinolin-4-yl)-N1,N1-diethylpentane-1,4-diamine oxalate
[Molecular Formula]

C18H26ClN3
[MOL File]

5428-61-5.mol
[Molecular Weight]

319.87
Chemical PropertiesBack Directory
[storage temp. ]

-20°C Freezer, Under inert atmosphere
[solubility ]

Chloroform (Slightly), Dichloromethane (Slightly), Ethyl Acetate
[form ]

Oil
[color ]

Dark Orange to Dark Brown
[biological source]

synthetic
[Major Application]

pharmaceutical (small molecule)
[InChI]

1S/C18H26ClN3/c1-4-22(5-2)13-7-8-14(3)21-17-11-12-20-16-10-6-9-15(19)18(16)17/h6,9-12,14H,4-5,7-8,13H2,1-3H3,(H,20,21)
[InChIKey]

CHDBGFBFAXJWRC-UHFFFAOYSA-N
[SMILES]

Clc1c2c(nccc2NC(CCCN(CC)CC)C)ccc1
Safety DataBack Directory
[WGK Germany ]

3
[HS Code ]

2933497050
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Uses]

N4-(5-Chloro-4-quinolinyl)-N1,N1-diethyl-1,4-pentanediamine is a metabolite of Chloroquine (C379965), a standard anti-malarial drug. Substrate for MRP in multidrug resistant cell line and inhibits photoaffinity labelling of MRP by quinoline-based photoactive drug IAAQ.
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