Acamprosate

Base Information

• Chemical Name: Acamprosate
• CAS No.: 77337-76-9
• Molecular Formula: C5H11NO4S
• Molecular Weight: 181.21
• Hs Code.: 2924199090
• European Community (EC) Number: 278-667-4
• UNII: N4K14YGM3J
• DSSTox Substance ID: DTXSID3044259
• Nikkaji Number: J309.380H
• Wikipedia: Acamprosate
• Wikidata: Q337668
• NCI Thesaurus Code: C81691
• RXCUI: 82819
• Pharos Ligand ID: NHKC2HCWANW8
• Metabolomics Workbench ID: 42977
• ChEMBL ID: CHEMBL1201293
• Mol file: 77337-76-9.mol

Synonyms:acamprosate;acamprosate calcium;acamprostate;Acetyl Homotaurinate, Calcium;Acetylhomotaurinate, Calcium;Acetylhomotaurine, Calcium;Acetylhomotaurine, Sodium;Aotal;calcium acetyl homotaurinate;calcium acetylhomotaurinate;calcium acetylhomotaurine;Campral;Campral EC;N Acetylhomotaurine;N Acetylhomotaurine, Monolithium Salt;N Acetylhomotaurine, Monopotassium Salt;N Acetylhomotaurine, Monosodium Salt;N-acetylhomotaurine;N-acetylhomotaurine, calcium (2:1) salt;N-acetylhomotaurine, magnesium (2:1) salt;N-acetylhomotaurine, monolithium salt;N-acetylhomotaurine, monopotassium salt;N-acetylhomotaurine, monosodium salt;N-acetylhomotaurine, zinc (2:1) salt;Regtect;sodium acetylhomotaurine;Zulex

Chemical Property of Acamprosate

Chemical Property:

• Refractive Index: 1.491
• PSA: 95.34000
• Density: 1.336 g/cm³
• LogP: 1.32150
• XLogP3: -1.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 181.04087901
• Heavy Atom Count: 11
• Complexity: 215

Purity/Quality:

99%, ^*data from raw suppliers

ACAMPROSATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Drug Classes: Substance Abuse Treatment Agents
• Canonical SMILES: CC(=O)NCCCS(=O)(=O)O
• Recent ClinicalTrials: Pharmacogenomics and Pharmacometabolomics of Acamprosate Treatment Outcome
• Recent EU Clinical Trials: Alcohol detoxification in primary care treatment (ADEPT) - a feasibility study of conducting a randomised trial in primary care comparing two pharmacological regimens.
• Uses: Treatment of alcohol dependency.