Diphenoxylate

Base Information

• Chemical Name: Diphenoxylate
• CAS No.: 915-30-0
• Molecular Formula: C30H32N2O2
• Molecular Weight: 452.596
• European Community (EC) Number: 213-020-1
• UNII: 73312P173G
• DSSTox Substance ID: DTXSID8022951
• Nikkaji Number: J7.167F
• Wikipedia: Diphenoxylate
• Wikidata: Q416431
• NCI Thesaurus Code: C62024
• RXCUI: 3500
• Pharos Ligand ID: V5974RZHJKSS
• Metabolomics Workbench ID: 43314
• ChEMBL ID: CHEMBL1201294
• Mol file: 915-30-0.mol

Synonyms:Diphenoxylate;Diphenoxylate Hydrochloride;Diphenoxylate Monohydrochloride;Hydrochloride, Diphenoxylate;Monohydrochloride, Diphenoxylate

 This product is a nationally controlled contraband, and the Lookchem platform doesn't provide relevant sales information.

Chemical Property of Diphenoxylate

Chemical Property:

• Appearance/Colour: White crystalline powder with no odor.
• Melting Point: 220 - 225oC
• Boiling Point: 602.3 °C at 760 mmHg
• PKA: pKa 7.1 (Uncertain)
• Flash Point: 318 °C
• PSA: 53.33000
• Density: 1.123 g/cm³
• LogP: 5.42118
• XLogP3: 5.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 9
• Exact Mass: 452.246378268
• Heavy Atom Count: 34
• Complexity: 666

Purity/Quality:

Safty Information:

• Pictogram(s): T+
• Hazard Codes: T+
• Statements: 26/27/28-42/43
• Safety Statements: 22-26-45

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Drug Classes: Gastrointestinal Agents; Opioids
• Canonical SMILES: CCOC(=O)C1(CCN(CC1)CCC(C#N)(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4
• Recent ClinicalTrials: Diphenoxylate / Atropine to Decrease FDG Activity During F-18 FDG PET
• Uses: This drug is a structural analog of meperidine and loperamide; however, it practically duplicates all of the pharmacological properties of loperamide. Being analogous to loperamide, it is mainly used for treating diarrhea. Synonyms for this drug are fentanest, leprofen, and others.
• Indications: Diphenoxylate (marketed in combination with atropine as Lomotil in the United States) is chemically related to both analgesic and anticholinergic compounds. It is as effective in the treatment of diarrhea as the opium derivatives, and at the doses usually employed, it has a low incidence of central opioid actions. Diphenoxylate is rapidly metabolized by ester hydrolysis to the biologically active metabolite difenoxylic acid.
• Clinical Use: Lomotil is recommended as adjunctive therapy in the management of diarrhea. It is contraindicated in children under 2 years old and in patients with obstructive jaundice.

Technology Process of Diphenoxylate

There total 1 articles about Diphenoxylate 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:

→ lomotil (915-30-0)

Guidance literature:

4-Brom-2,2-diphenyl-buttersaeurenitril, 4-Phenyl-4-ethoxycarbonyl-piperidin, Xylol (120grad);

Refernces