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Chemical structure of UM4118

GC73994

UM4118

Also known as N-quinolin-8-ylpyridine-2-carboxamide

UM4118 is a copper ionophore that can initiate a mitochondrial-based noncanonical form of cell death known as cuproptosis

ChemicalCAS324530-92-9MW249.27FormulaC15H11N3O
CAS number
324530-92-9
Molecular weight
249.27
Formula
C15H11N3O
Solubility
DMSO : 116·67 mg/mL (468·05 mM; ultrasonic and warming and heat to 60°C)
InChIKey
RZQZPRDJYGINCD-UHFFFAOYSA-N
Catalogue number
GC73994
Brand
GLPBIO
Computed properties PubChem CID 12090074 · XLogP 2.8 · TPSA 54.9 Ų · H-bond donors 1
XLogP
2.8
TPSA
54.9 Ų
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
19

SMILES C1=CC=NC(=C1)C(=O)NC2=CC=CC3=C2N=CC=C3

Computed descriptors from PubChem (CID 12090074), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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