Ranitidine-N-oxide

Base Information

• Chemical Name: Ranitidine-N-oxide
• CAS No.: 73857-20-2
• Molecular Formula: C₁₃H₂₂N₄O₄S
• Molecular Weight: 330.408
• UNII: K131L1Z4KY
• DSSTox Substance ID: DTXSID50891465
• Wikidata: Q27156881
• Mol file: 73857-20-2.mol

Synonyms:ranitidine N-oxide;ranitidine N-oxide hydrochloride

Chemical Property of Ranitidine-N-oxide

Chemical Property:

• PKA: 4.46±0.40(Predicted)
• PSA: 137.75000
• LogP: 2.79750
• Storage Temp.: Hygroscopic, -20°C Freezer, Under Inert Atmosphere
• Solubility.: DMSO (Slightly, Sonicated), Methanol (Slightly)
• XLogP3: -0.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 9
• Exact Mass: 330.13617637
• Heavy Atom Count: 22
• Complexity: 387

Purity/Quality:

98%Min ^*data from raw suppliers

Ranitidine N-oxide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CNC(=C[N+](=O)[O-])NCCSCC1=CC=C(O1)C[N+](C)(C)[O-]
• Uses: Ranitidine N-Oxide (Ranitidine EP Impurity E) is a metabolite of Ranitidine (R120000).

Technology Process of Ranitidine-N-oxide

There total 1 articles about Ranitidine-N-oxide 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:

ranitidine hydrochloride (66357-35-5,66357-59-3,71130-06-8,358638-36-5) → C12H20N4O3S + C13H22N4O4S (73857-20-2) + Ranitidine S-oxide (73851-70-4)

Guidance literature:

With rat hepatocyte; In water; Further Variations:; Reagents; Enzyme kinetics;

DOI:10.3109/00498259509061858

upstream raw materials:

ranitidine hydrochloride

Refernces