Tianeptine

Base Information

• Chemical Name: Tianeptine
• CAS No.: 72797-41-2
• Deprecated CAS: 66981-73-5
• Molecular Formula: C21H25ClN2O4S
• Molecular Weight: 436.9575
• European Community (EC) Number: 276-851-9,614-004-0
• UNII: XV6773012I,0T493YFU8O,AKU7QFL9ZT
• DSSTox Substance ID: DTXSID7048295
• Nikkaji Number: J34.292K
• Wikipedia: Tianeptine
• Wikidata: Q424260
• NCI Thesaurus Code: C152599
• Metabolomics Workbench ID: 49708
• ChEMBL ID: CHEMBL1289110
• Mol file: 72797-41-2.mol

Synonyms:(3-chloro-6-methyl-5,5-dioxo-6,11-dihydrodibenzo(c,f)(1,2)thiazepin-11-yl)-7-aminoheptanoic acid;coaxil;Stablon;tianeptine;tianeptine, (+-)-isomer;tianeptine, monosodium salt;tianeptine, monosodium salt, (+-)-isomer

Chemical Property of Tianeptine

Chemical Property:

• Vapor Pressure: 0.001Pa at 25℃
• Melting Point: 129-131?C
• Boiling Point: 609.2±65.0 °C(Predicted)
• PKA: 4.75±0.10(Predicted)
• PSA: 95.09000
• Density: 1.38±0.1 g/cm3(Predicted)
• LogP: 5.72930
• Storage Temp.: Refrigerator, Under Inert Atmosphere
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 8
• Exact Mass: 436.1223562
• Heavy Atom Count: 29
• Complexity: 654

Purity/Quality:

99.9% ^*data from raw suppliers

Tianeptine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1C2=CC=CC=C2C(C3=C(S1(=O)=O)C=C(C=C3)Cl)NCCCCCCC(=O)O
• Recent ClinicalTrials: Non-interventional, Retrospective Cohort Study to Explore Antidepressant Treatment in Korea
• Recent EU Clinical Trials: Efficacy and safety of tianeptine oral administration (25 to 50 mg/day) in elderly patients suffering from Major Depressive Disorder.
• Uses: Tricyclic compound with psychostimulant, anti-ulcer and anti-emetic properties. Antidepressant.