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Chemical structure of Ruzinurad

GC63422

Ruzinurad

Also known as 1-(6-bromoquinolin-4-yl)sulfanylcyclobutane-1-carboxylic acid

Ruzinurad is a highly selective URATl inhibitor (WO2020088641, compound I)

ChemicalCAS1638327-48-6MW338.22FormulaC14H12BrNO2S
CAS number
1638327-48-6
Molecular weight
338.22
Formula
C14H12BrNO2S
Solubility
DMSO : 33·33 mg/mL (98·55 mM; ultrasonic and warming and heat to 60°C)
InChIKey
QGBWIYLNOBYNDL-UHFFFAOYSA-N
Catalogue number
GC63422
Brand
GLPBIO
Computed properties PubChem CID 86294127 · XLogP 3.7 · TPSA 75.5 Ų · H-bond donors 1
XLogP
3.7
TPSA
75.5 Ų
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
19

SMILES C1CC(C1)(C(=O)O)SC2=C3C=C(C=CC3=NC=C2)Br

Computed descriptors from PubChem (CID 86294127), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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