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Chemical structure of Omeprazole sulfide

GC44509

Omeprazole sulfide

Also known as 6-methoxy-2-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methylsulfanyl]-1H-benzimidazole

Omeprazole sulfide is an intermediate used in the production of the gastric proton pump inhibitors, omeprazole and esomeprazole

ChemicalCAS73590-85-9MW329.4FormulaC17H19N3O2S
CAS number
73590-85-9
Molecular weight
329.4
Formula
C17H19N3O2S
Solubility
DMF： 30 mg/ml,DMF：PBS(pH 7·2)(1：1)： 0·5 mg/ml,DMSO： 30 mg/ml,Ethanol： 25 mg/ml
InChIKey
XURCIPRUUASYLR-UHFFFAOYSA-N
Catalogue number
GC44509
Brand
GLPBIO
Computed properties PubChem CID 155794 · XLogP 3.5 · TPSA 85.3 Ų · H-bond donors 1
XLogP
3.5
TPSA
85.3 Ų
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
23

SMILES CC1=CN=C(C(=C1OC)C)CSC2=NC3=C(N2)C=C(C=C3)OC

Computed descriptors from PubChem (CID 155794), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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