Omeprazole magnesiumProduct ingredient for Omeprazole
- Name
- Omeprazole magnesium
- Drug Entry
- Omeprazole
Originally approved by the FDA in 1989, omeprazole is a proton-pump inhibitor, used to treat gastric acid-related disorders. These disorders may include gastroesophageal reflux disease (GERD), peptic ulcer disease, and other diseases characterized by the oversecretion of gastric acid. This drug was the first clinical useful drug in its class, and its approval was followed by the formulation of many other proton pump inhibitor drugs 6. Omeprazole is generally effective and well-tolerated, promoting its popular use in children and adults Label.
- Accession Number
- DBSALT000131
- Structure
Structure for Omeprazole magnesium (DBSALT000131)
- Synonyms
- Not Available
- UNII
- 426QFE7XLK
- CAS Number
- 95382-33-5
- Weight
- Average: 713.121
Monoisotopic: 712.198816192 - Chemical Formula
- C34H36MgN6O6S2
- InChI Key
- KWORUUGOSLYAGD-UHFFFAOYSA-N
- InChI
- InChI=1S/2C17H18N3O3S.Mg/c2*1-10-8-18-15(11(2)16(10)23-4)9-24(21)17-19-13-6-5-12(22-3)7-14(13)20-17;/h2*5-8H,9H2,1-4H3;/q2*-1;+2
- IUPAC Name
- magnesium(2+) bis(6-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methanesulfinyl]-1H-1,3-benzodiazol-1-ide)
- SMILES
- [Mg++].COC1=CC2=C(C=C1)N=C([N-]2)S(=O)CC1=C(C)C(OC)=C(C)C=N1.COC1=CC2=C(C=C1)N=C([N-]2)S(=O)CC1=C(C)C(OC)=C(C)C=N1
- External Links
- PubChem Compound
- 130564
- ChemSpider
- 115498
- ChEBI
- 94401
- ChEMBL
- CHEMBL1567328
- Predicted Properties
Property Value Source Water Solubility 0.0165 mg/mL ALOGPS logP 3.51 ALOGPS logP 2.43 Chemaxon logS -4.6 ALOGPS pKa (Strongest Acidic) 9.29 Chemaxon pKa (Strongest Basic) 4.77 Chemaxon Physiological Charge 0 Chemaxon Hydrogen Acceptor Count 6 Chemaxon Hydrogen Donor Count 0 Chemaxon Polar Surface Area 74.2 Å2 Chemaxon Rotatable Bond Count 10 Chemaxon Refractivity 94.27 m3·mol-1 Chemaxon Polarizability 37.13 Å3 Chemaxon Number of Rings 6 Chemaxon Bioavailability 1 Chemaxon Rule of Five No Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule Yes Chemaxon