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Chemical structure of WRN inhibitor 4

GC73663

WRN inhibitor 4

Also known as N-[(3R)-1,1-dioxo-2,3-dihydrothiophen-3-yl]-5-hydroxy-2-oxo-6-phenyl-1H-pyridine-3-carboxamide

WRN inhibitor 4 (example 107), a cyclic vinyl sulfone compound, is a Wemer Syndrome ATP dependent helicase enzyme (WRN) inhibitor

ChemicalCAS2923009-45-2MW346.36FormulaC16H14N2O5S
CAS number
2923009-45-2
Molecular weight
346.36
Formula
C16H14N2O5S
Solubility
DMSO ： 100 mg/mL (288·72 mM; Need ultrasonic)
InChIKey
HFIIQCVNTGZNPC-LLVKDONJSA-N
Catalogue number
GC73663
Brand
GLPBIO
Computed properties PubChem CID 168205735 · XLogP 0.1 · TPSA 121 Ų · H-bond donors 3
XLogP
0.1
TPSA
121 Ų
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
24

SMILES C1[C@@H](C=CS1(=O)=O)NC(=O)C2=CC(=C(NC2=O)C3=CC=CC=C3)O

Computed descriptors from PubChem (CID 168205735), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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