Oxyquinoline sulfateProduct ingredient for Oxyquinoline

Name
Oxyquinoline sulfate
Drug Entry
Oxyquinoline

Oxyquinoline is a heterocyclic phenol and derivative of quinoline with antiseptic, disinfectant, and pesticide properties. It is used as a stabilizer for hydrogen peroxide, where it is sometimes added in cosmetic products.

Accession Number
DBSALT001527
Structure
Thumb
Synonyms
Oxyquinoline sulphate
UNII
61VUG75Y3P
CAS Number
134-31-6
Weight
Average: 388.39
Monoisotopic: 388.072907417
Chemical Formula
C18H16N2O6S
InChI Key
YYVFXSYQSOZCOQ-UHFFFAOYSA-N
InChI
InChI=1S/2C9H7NO.H2O4S/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;1-5(2,3)4/h2*1-6,11H;(H2,1,2,3,4)
IUPAC Name
bis(quinolin-8-ol); sulfuric acid
SMILES
OS(O)(=O)=O.OC1=C2N=CC=CC2=CC=C1.OC1=C2N=CC=CC2=CC=C1
External Links
KEGG Compound
C18478
ChemSpider
8318
ChEMBL
CHEMBL1697698
Predicted Properties
PropertyValueSource
Water Solubility4.18 mg/mLALOGPS
logP1.91ALOGPS
logP1.83ChemAxon
logS-1.5ALOGPS
pKa (Strongest Acidic)9.36ChemAxon
pKa (Strongest Basic)4.83ChemAxon
Physiological Charge0ChemAxon
Hydrogen Acceptor Count2ChemAxon
Hydrogen Donor Count1ChemAxon
Polar Surface Area33.12 Å2ChemAxon
Rotatable Bond Count0ChemAxon
Refractivity41.96 m3·mol-1ChemAxon
Polarizability14.87 Å3ChemAxon
Number of Rings4ChemAxon
Bioavailability1ChemAxon
Rule of FiveYesChemAxon
Ghose FilterYesChemAxon
Veber's RuleYesChemAxon
MDDR-like RuleNoChemAxon