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Chemical structure of Ferroquine (Ferrochloroquine)

GC32125

Ferroquine (Ferrochloroquine)

Also known as 7-chloro-N-[[2-[(dimethylamino)methyl]cyclopenta-1,4-dien-1-yl]methyl]quinolin-4-amine;cyclopenta-1,3-diene;iron(2+)

Ferroquine (Ferrochloroquine) (Ferrochloroquine), a ferrocenyl analogue of Chloroquine, is an antimalarial agent

ChemicalCAS185055-67-8MW433.75FormulaC23H24ClFeN3
CAS number
185055-67-8
Molecular weight
433.75
Formula
C23H24ClFeN3
Solubility
DMSO ： 8·33 mg/mL (19·20 mM)
InChIKey
DLYPREQTTOHKSM-UHFFFAOYSA-N
Catalogue number
GC32125
Brand
GLPBIO
Computed properties PubChem CID 56841801 · TPSA 28.2 Ų · H-bond donors 1 · H-bond acceptors 5
TPSA
28.2 Ų
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
28

SMILES CN(C)CC1=C(C=[C-]C1)CNC2=C3C=CC(=CC3=NC=C2)Cl.C1C=CC=[C-]1.[Fe+2]

Computed descriptors from PubChem (CID 56841801), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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