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Chemical structure of Elesclomol

GC13885

Elesclomol

Also listed as Elesclomol (STA-4783)

Elesclomol (also known as STA-4783), originally identified in a cell-based phenotypic screen for proapoptotic activity, is a novel small-molecule that potently induces apoptosis of cancer cells through the rapid generation of reactive oxygen species (ROS) and the induction of unmanageable levels of oxidative stress

ChemicalCAS488832-69-5MW400.5FormulaC19H20N4O2S2
CAS number
488832-69-5
Molecular weight
400.5
Formula
C19H20N4O2S2
Solubility
≥ 20·15mg/mL in DMSO, ≥ 5·68 mg/mL in EtOH with ultrasonic and warming
InChIKey
BKJIXTWSNXCKJH-UHFFFAOYSA-N
Catalogue number
GC13885
Brand
GLPBIO
Computed properties PubChem CID 300471 · XLogP 2.9 · TPSA 129 Ų · H-bond donors 2
XLogP
2.9
TPSA
129 Ų
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
27

SMILES CN(C(=S)C1=CC=CC=C1)NC(=O)CC(=O)NN(C)C(=S)C2=CC=CC=C2

Computed descriptors from PubChem (CID 300471), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Documents
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