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Chemical structure of Merbarone

GC61844

Merbarone

Also known as 6-hydroxy-4-oxo-N-phenyl-2-sulfanylidene-1H-pyrimidine-5-carboxamide

Merbarone (NSC 336628) is an orally active inhibitor of topoisomerase II· Merbarone acts primarily by blocking topoisomerase II-mediated DNA cleavage without stabilizing topo II-DNA covalent complexes· Merbarone is an anticancer agent

ChemicalCAS97534-21-9MW263.27FormulaC11H9N3O3S
CAS number
97534-21-9
Molecular weight
263.27
Formula
C11H9N3O3S
InChIKey
GFYRZTLCYQQVHZ-UHFFFAOYSA-N
Catalogue number
GC61844
Brand
GLPBIO
Computed properties PubChem CID 3000671 · XLogP 1.1 · TPSA 123 Ų · H-bond donors 4
XLogP
1.1
TPSA
123 Ų
H-bond donors
4
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
18

SMILES C1=CC=C(C=C1)NC(=O)C2=C(NC(=S)NC2=O)O

Computed descriptors from PubChem (CID 3000671), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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