Metamizole magnesiumProduct ingredient for Metamizole

Name
Metamizole magnesium
Drug Entry
Metamizole

Metamizole (dipyrone) is a pyrazolone derivative that belongs to the group of nonacid nonopioids. It is considered a potent analgesic and antipyretic with favourable gastrointestinal tolerability.2 Metamizole was formerly marketed in the US as Dimethone tablets and injection, Protemp oral liquid, and other drug products, and was withdrawn due to its association with potentially fatal agranulocytosis. Approvals of the NDA's for metamizole drug products were withdrawn on June 27, 1977 (see the Federal Register of June 17, 1977, 42 FR 30893).9 In 1963, metamizole was withdrawn from the Canadian market and banned in the UK, France, Sweden, Norway and Australia.1 Metamizole is still used in certain countries in Europe, Asia and South America.1

Accession Number
DBSALT002439
Structure
Synonyms
Dipyrone magnesium / Dipyrone magnesium salt
UNII
MS15642725
CAS Number
6150-97-6
Weight
Average: 645.0
Monoisotopic: 644.15734606
Chemical Formula
C26H32MgN6O8S2
InChI Key
NHMUJYOBLYTIKO-UHFFFAOYSA-L
InChI
InChI=1S/2C13H17N3O4S.Mg/c2*1-10-12(14(2)9-21(18,19)20)13(17)16(15(10)3)11-7-5-4-6-8-11;/h2*4-8H,9H2,1-3H3,(H,18,19,20);/q;;+2/p-2
IUPAC Name
magnesium(2+) bis([(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)(methyl)amino]methanesulfonate)
SMILES
[Mg++].CN(CS([O-])(=O)=O)C1=C(C)N(C)N(C1=O)C1=CC=CC=C1.CN(CS([O-])(=O)=O)C1=C(C)N(C)N(C1=O)C1=CC=CC=C1
ChemSpider
8502319
Predicted Properties
PropertyValueSource
Water Solubility0.0922 mg/mLALOGPS
logP2.21ALOGPS
logP-0.82Chemaxon
logS-3.8ALOGPS
pKa (Strongest Acidic)-1.4Chemaxon
pKa (Strongest Basic)-0.54Chemaxon
Physiological Charge-1Chemaxon
Hydrogen Acceptor Count6Chemaxon
Hydrogen Donor Count0Chemaxon
Polar Surface Area83.99 Å2Chemaxon
Rotatable Bond Count8Chemaxon
Refractivity78.92 m3·mol-1Chemaxon
Polarizability30.26 Å3Chemaxon
Number of Rings4Chemaxon
Bioavailability1Chemaxon
Rule of FiveNoChemaxon
Ghose FilterNoChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleYesChemaxon