Pantoprazole Sodium

Base Information

• Chemical Name: Pantoprazole Sodium
• CAS No.: 138786-67-1
• Molecular Formula: C16H15F2N3NaO4S
• Molecular Weight: 405.357
• Hs Code.: 2933990090
• European Community (EC) Number: 604-093-4
• ChEMBL ID: CHEMBL1200408
• DSSTox Substance ID: DTXSID7044215
• NCI Thesaurus Code: C61877
• RXCUI: 253191
• Wikidata: Q27122012
• Mol file: 138786-67-1.mol

Synonyms:BY 1023;BY-1023;BY1023;pantoprazole;pantoprazole sodium;Protonix;SK and F 96022;SK and F-96022;SK and F96022;SKF 96022;SKF-96022;SKF96022

Chemical Property of Pantoprazole Sodium

Chemical Property:

• Appearance/Colour: white to off-white solid
• Melting Point: 199-202 °C
• Boiling Point: 586.9oC at 760 mmHg
• Flash Point: 308.7oC
• PSA: 94.68000
• LogP: 3.53580
• Storage Temp.: -20°C Freezer
• Solubility.: DMSO (Slightly), Methanol (Slightly, Sonicated), Water (Slightly)
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 7
• Exact Mass: 405.05707772
• Heavy Atom Count: 27
• Complexity: 497

Purity/Quality:

99% ^*data from raw suppliers

Pantoprazole, Sodium Salt ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 20/21/22-37/38-41-48
• Safety Statements: 22-26-36/37/39-45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C(=NC=C1)CS(=O)C2=NC3=C([N-]2)C=CC(=C3)OC(F)F)OC.[Na+]
• Recent ClinicalTrials: Pantoprazole With Doxorubicin for Advanced Cancer Patients With Extension Cohort of Patients With Solid Tumours
• Recent EU Clinical Trials: An Open-Label, Multicenter Study To Evaluate The Pharmacokinetics Of Single And Multiple Intravenous Doses Of Pantoprazole In Two Age Cohorts Of Hospitalized Pediatric Subjects 1 To 16 Years Of Age Who Are Candidates For Acid Suppression Therapy
• Uses: An antiulcerative. Gastric pump inhibitor. An antiulcerative. Gastric pump inhibitor Gastrointestinal
• Therapeutic Function: Antiulcer

Technology Process of Pantoprazole Sodium

There total 13 articles about Pantoprazole Sodium which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 100.0%

→ pantoprazole sodium (138786-67-1)

Guidance literature:

Purification / work up;

Reference yield: 95.0%

5-(difluoromethoxy)-2-[[(3,4-dimethoxy-2-pyridyl)methyl]sulfinyl]-1H-benzimidazole (102625-70-7) → pantoprazole sodium (138786-67-1)

Guidance literature:

With sodium hydroxide; In water; acetonitrile; at 20 ℃;

Reference yield: 95.0%

pantoprazole sulfide (102625-64-9) → pantoprazole sodium (138786-67-1)

Guidance literature:

pantoprazole sulfide; With sodium hydroxide; tert-butylhypochlorite; In dichloromethane; water; at 0 - 5 ℃; for 1h;

With sodium hydroxide; In water; acetone; at 0 - 25 ℃; for 7h;

upstream raw materials:

5-(difluoromethoxy)-2-[[(3,4-dimethoxy-2-pyridyl)methyl]sulfinyl]-1H-benzimidazole

(5-difluoromethoxy)-2-[(4-chloro-3-methoxy-2-pyridinyl)methyl]thio-1H-benzimidazole

sodium methylate

5-(difluoromethoxy)-2-[[(4-chloro-3-methoxy-2-pyridinyl)methyl]sulfinyl]-1H-benzimidazole

Downstream raw materials:

3-[6-difluoromethoxy-2-{(3,4-dimethoxy-pyridin-2-yl)-methanesulfinyl}-benzimidazole-1-sulfonyl]benzoic acid 2-(toluene-4-sulfonyl)ethyl ester

4-[6-difluoromethoxy-2-{(3,4-dimethoxypyridin-2-yl)methanesulfinyl}benzimidazole-1-sulfonyl]phenoxyacetic acid 2-(toluene-4-sulfonyl)ethyl ester

5-(difluoromethoxy)-2-[[(3,4-dimethoxy-2-pyridinyl)-chloromethyl]sulfinyl]-1H-benzimidazole

5-(difluoromethoxy)-2-[[(3,4-dimethoxy-2-pyridinyl)chlorohydroxymethyl]sulfinyl]-1H-benzimidazole