Products for Research Use Only

Pantoprazole Sodium Hydrate

CAT: 0013-GTR19206807-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19206807-01Size:100 mg
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Description
Pantoprazole Sodium Hydrate is a proton pump inhibitor (PPI) used in research to study gastric acid suppression. It is applied in both in vitro enzymatic assays and in vivo models for investigating GERD, peptic ulcers, and related gastrointestinal disorders.
CAS Number
164579-32-2
Product Name Alternative
SKF 96022, release, Protonpump, Proton Pump, Proton pump, stability, SKF96022, SKF-96022, SKF96022 (sodium hydrate), SKF96022 sodium, SKF96022 sodium hydrate, SKF96022 sodium Hydrate, sodium Hydrate, Potassium Channel, PotassiumChannel, Potassium-transporting ATPase, PPI, A431, anti-ulcer, anti-secretory, Apoptosis, Autophagy, BY 1023, BY1023, BY-1023, BY1023 (sodium hydrate), BY1023 sodium, Doxorubicin, Pantoprazole sodium, Pantoprazole Sodium Hydrate, orally, Inhibitor, inhibit, MCF-7, H+/K+-ATPase, exosome
Field of Research
Cell Biology, Infectious Disease & Virology, Pharmacology & Drug Discovery
Purity
96.63% (May vary between batches)
Solubility
DMSO:4.37 mg/mL (10.11 mM) ;10% DMSO+40% PEG300+5% Tween 80+45% Saline:1 mg/mL (2.31 mM)
Smiles
O.[Na+].COc1ccnc (CS (=O) c2nc3cc (OC (F) F) ccc3[n-]2) c1OC
Molecular Formula
C16H14F2N3NaO4S·3/2H2O
Molecular Weight
432.37
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Pantoprazole sodium sesquihydrate
CAS Number164579-32-2
PubChem CID67047490
Molecular FormulaC16H17F2N3NaO5S
Molecular Weight424.4
Topological Polar Surface Area107
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count10
Rotatable Bond Count7
Heavy Atom Count28
Formal Charge0
Complexity490
SMILES
COC1=C(C(=NC=C1)CS(=O)C2=NC3=C(N2)C=C(C=C3)OC(F)F)OC.O.[Na]
InChI
InChI=1S/C16H15F2N3O4S.Na.H2O/c1-23-13-5-6-19-12(14(13)24-2)8-26(22)16-20-10-4-3-9(25-15(17)18)7-11(10)21-16;;/h3-7,15H,8H2,1-2H3,(H,20,21);;1H2
InChIKey
RJRBTVMZZGMTQI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Pantoprazole sodium sesquihydrate
CAS: 164579-32-2
CID: 67047490
Formula: C16H17F2N3NaO5S
MW: 424.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight424.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count10
Rotatable Bond Count7
Exact Mass424.07546743
Monoisotopic Mass424.07546743
Topological Polar Surface Area107 Ų
Heavy Atom Count28
Formal Charge0
Complexity490
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes