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Chemical structure of Pantoprazole sodium

GC36847

Pantoprazole sodium

Also known as sodium 5-(difluoromethoxy)-2-[(3,4-dimethoxy-2-pyridinyl)methylsulfinyl]benzimidazol-1-ide

Pantoprazole sodium (BY10232 sodium) is an orally active and potent proton pump inhibitor (PPI)

ChemicalCAS138786-67-1MW405.35FormulaC16H14F2N3NaO4S
CAS number
138786-67-1
Molecular weight
405.35
Formula
C16H14F2N3NaO4S
Solubility
DMSO： ≥ 100 mg/mL (246·70 mM); Water： 3·85 mg/mL (9·50 mM)
InChIKey
YNWDKZIIWCEDEE-UHFFFAOYSA-N
Catalogue number
GC36847
Brand
GLPBIO
Computed properties PubChem CID 15008962 · TPSA 90.8 Ų · H-bond donors 0 · H-bond acceptors 10
TPSA
90.8 Ų
H-bond donors
0
H-bond acceptors
10
Rotatable bonds
7
Heavy atoms
27

SMILES COC1=C(C(=NC=C1)CS(=O)C2=NC3=C([N-]2)C=CC(=C3)OC(F)F)OC.[Na+]

Computed descriptors from PubChem (CID 15008962), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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