Omeprazole

• CAS: 73590-58-6
• Catalog Number: ACM73590586
• Category: Inhibitors
• Molecular Weight: 345.42
• Molecular Formula: C17H19N3O3S
• Description: Omeprazole (H 16868), a proton pump inhibitor (PPI), is available for treatment of acid-related gastrointestinal disorders. Omeprazole shows competitive inhibition of CYP2C19 activity with a Ki of 2 to 6 μM. Omeprazole also inhibits growth of Gram-positive and Gram-negative bacteria.Omeprazole is a potent brain penetrant neutral sphingomyelinase (N-SMase) inhibitor (exosome inhibitor).
• Synonyms: 2-Chloromethyl-3,5-dinmethyl-4-methoxypyridine
• IUPAC Name: 6-Methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfinyl]-1H-benzimidazole
• Canonical SMILES: CC1=CN=C(C(=C1OC)C)CS(=O)C2=NC3=C(N2)C=C(C=C3)OC
• InChI: InChI=1S/C17H19N3O3S/c1-10-8-18-15(11(2)16(10)23-4)9-24(21)17-19-13-6-5-12(22-3)7-14(13)20-17/h5-8H,9H2,1-4H3,(H,19,20)
• InChI Key: SUBDBMMJDZJVOS-UHFFFAOYSA-N
• Boiling Point: 600.0±60.0 °C(Predicted)
• Melting Point: 156 °C
• Flash Point: 9 °C
• Density: 1.332 g/cm³
• Appearance: White solid
• Storage: 2-8 °C
• Complexity: 453
• Exact Mass: 345.11471265
• Monoisotopic Mass: 345.11471265
• Shipping: Can be shipped at room temperature, where not in use may vary.
• Topological Polar Surface Area: 96.3 Ų