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Chemical structure of chinifur

GC25239

chinifur

Also known as N-[5-(diethylamino)pentan-2-yl]-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]quinoline-4-carboxamide

Chinifur, a selective inhibitor and "subversive substrate" for Trypanosoma congolense trypanothione reductase

ChemicalCAS70762-66-2MW450.53FormulaC25H30N4O4
CAS number
70762-66-2
Molecular weight
450.53
Formula
C25H30N4O4
Solubility
DMSO： 5 mg/mL (11·10 mM);Water： Insoluble;Ethanol： 2 mg/mL (4·44 mM)
InChIKey
MTHCJDYSIZMKAC-OUKQBFOZSA-N
Catalogue number
GC25239
Brand
GLPBIO
Computed properties PubChem CID 6443617 · XLogP 5 · TPSA 104 Ų · H-bond donors 1
XLogP
5
TPSA
104 Ų
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
33

SMILES CCN(CC)CCCC(C)NC(=O)C1=CC(=NC2=CC=CC=C21)/C=C/C3=CC=C(O3)[N+](=O)[O-]

Computed descriptors from PubChem (CID 6443617), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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