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Details

Stereochemistry ACHIRAL
Molecular Formula C18H19ClN3.C5H5.Fe
Molecular Weight 433.755
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FERROQUINE

SMILES

[Fe++].[CH-]1C=CC=C1.CN(C)CC2=C[CH-]C=C2CNC3=CC=NC4=CC(Cl)=CC=C34

InChI

InChIKey=DDENDDKMBDTHAX-UHFFFAOYSA-N
InChI=1S/C18H19ClN3.C5H5.Fe/c1-22(2)12-14-5-3-4-13(14)11-21-17-8-9-20-18-10-15(19)6-7-16(17)18;1-2-4-5-3-1;/h3-10H,11-12H2,1-2H3,(H,20,21);1-5H;/q2*-1;+2

HIDE SMILES / InChI

Molecular Formula C18H19ClN3
Molecular Weight 312.817
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C5H5
Molecular Weight 65.0932
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Fe
Molecular Weight 55.845
Charge 2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

FERROQUINE, a ferrocene-quinoline conjugate, is an antimalarial drug currently undergoing a clinical evaluation. It is also a promising candidate for repositioning as cancer therapeutics.

Approval Year

PubMed

PubMed

TitleDatePubMed
Synthesis and antimalarial activity in vitro and in vivo of a new ferrocene-chloroquine analogue.
1997 Nov 7
Insights into the mechanism of action of ferroquine. Relationship between physicochemical properties and antiplasmodial activity.
2005 May-Jun
Phase I randomized dose-ascending placebo-controlled trials of ferroquine--a candidate anti-malarial drug--in adults with asymptomatic Plasmodium falciparum infection.
2011 Mar 1
Ferroquine, the next generation antimalarial drug, has antitumor activity.
2017 Nov 21
Substance Class Chemical
Created
by admin
on Sat Dec 16 17:17:34 UTC 2023
Edited
by admin
on Sat Dec 16 17:17:34 UTC 2023
Record UNII
8D81JS19ET
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FERROQUINE
INN   WHO-DD  
INN  
Official Name English
SSR-97193
Code English
ferroquine [INN]
Common Name English
SSR97193
Code English
7-CHLORO-4-(((2-((DIMETHYLAMINO)METHYL)FERROCENYL)METHYL)AMINO)QUINOLONE
Common Name English
Ferroquine [WHO-DD]
Common Name English
FERROCHLOROQUINE
Common Name English
FERROCENE, 1-(((7-CHLORO-4-QUINOLINYL)AMINO)METHYL)-2-((DIMETHYLAMINO)METHYL)-
Systematic Name English
Code System Code Type Description
NCI_THESAURUS
C171721
Created by admin on Sat Dec 16 17:17:35 UTC 2023 , Edited by admin on Sat Dec 16 17:17:35 UTC 2023
PRIMARY
PUBCHEM
86574135
Created by admin on Sat Dec 16 17:17:35 UTC 2023 , Edited by admin on Sat Dec 16 17:17:35 UTC 2023
PRIMARY
INN
8774
Created by admin on Sat Dec 16 17:17:35 UTC 2023 , Edited by admin on Sat Dec 16 17:17:35 UTC 2023
PRIMARY
SMS_ID
100000175849
Created by admin on Sat Dec 16 17:17:35 UTC 2023 , Edited by admin on Sat Dec 16 17:17:35 UTC 2023
PRIMARY
EPA CompTox
DTXSID00939922
Created by admin on Sat Dec 16 17:17:35 UTC 2023 , Edited by admin on Sat Dec 16 17:17:35 UTC 2023
PRIMARY
FDA UNII
8D81JS19ET
Created by admin on Sat Dec 16 17:17:35 UTC 2023 , Edited by admin on Sat Dec 16 17:17:35 UTC 2023
PRIMARY
CAS
185055-67-8
Created by admin on Sat Dec 16 17:17:35 UTC 2023 , Edited by admin on Sat Dec 16 17:17:35 UTC 2023
PRIMARY
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