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Lansoprazole sodium

CAT: 0013-GTR19217512-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19217512-01Size:100 mg
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Description
Lansoprazole sodium is a proton pump inhibitor (PPI) and a potent inhibitor of gastric acidity which is widely used in the therapy of gastroesophageal reflux and peptic ulcer disease. (In Vivo) :Repeated administration of lansoprazole to humans induces the hepatic microsomal P-450-dependent drug oxidation system that mediates N-1-demethylation of theophylline, consequently increasing its metabolism.
CAS Number
226904-00-3
Product Name Alternative
Lansoprazole (sodium) | ?AG-1749 sodium
Field of Research
Pharmacology & Drug Discovery
Purity
>98% (HPLC)
Smiles
O=S (C1=NC2=CC=CC=C2[N-]1) CC3=NC=CC (OCC (F) (F) F) =C3C.[Na+]
Molecular Formula
C16H13F3N3NaO2S
Molecular Weight
391.34
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

Lansoprazole Sodium

See also: Lansoprazole (has active moiety).

CAS Number226904-00-3
PubChem CID12044540
IUPAC Namesodium 2-[[3-methyl-4-(2,2,2-trifluoroethoxy)-2-pyridinyl]methylsulfinyl]benzimidazol-1-ide
Molecular FormulaC16H13F3N3NaO2S
Molecular Weight391.3
Topological Polar Surface Area72.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count9
Rotatable Bond Count5
Heavy Atom Count26
Formal Charge0
Complexity486
SMILES
CC1=C(C=CN=C1CS(=O)C2=NC3=CC=CC=C3[N-]2)OCC(F)(F)F.[Na+]
InChI
InChI=1S/C16H13F3N3O2S.Na/c1-10-13(20-7-6-14(10)24-9-16(17,18)19)8-25(23)15-21-11-4-2-3-5-12(11)22-15;/h2-7H,8-9H2,1H3;/q-1;+1
InChIKey
OTGPYEHFRKGRIZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Lansoprazole Sodium
CAS: 226904-00-3
CID: 12044540
Formula: C16H13F3N3NaO2S
MW: 391.3
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight391.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count9
Rotatable Bond Count5
Exact Mass391.05782661
Monoisotopic Mass391.05782661
Topological Polar Surface Area72.3 Ų
Heavy Atom Count26
Formal Charge0
Complexity486
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes