Isothipendyl hydrochloride

Base Information

• Chemical Name: Isothipendyl hydrochloride
• CAS No.: 1225-60-1
• Molecular Formula: C16H19 N3 S . Cl H
• Molecular Weight: 321.90
• European Community (EC) Number: 214-957-9,252-022-7
• NSC Number: 169186
• UNII: 953AP1LBV8
• DSSTox Substance ID: DTXSID1046845
• Wikidata: Q27271733
• NCI Thesaurus Code: C76063
• ChEMBL ID: CHEMBL2107246
• Mol file: 1225-60-1.mol

Synonyms:10-(2-dimethylamino-2-methylethyl)-10H-pyrido(3,2- b)(1,4)benzothiazine;Andantol;Andanton;Estamyl;isothipendyl;isothipendyl hydrochloride;Sedermyl

Chemical Property of Isothipendyl hydrochloride

Chemical Property:

• Vapor Pressure: 2.63E-07mmHg at 25°C
• Melting Point: 215-220 °C
• Boiling Point: 421.3°C at 760 mmHg
• Flash Point: 208.6°C
• PSA: 44.67000
• LogP: 4.50140
• Storage Temp.: Hygroscopic, Refrigerator, under inert atmosphere
• Solubility.: DMSO (Slightly, Heated), Methanol (Slightly)
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 321.1066465
• Heavy Atom Count: 21
• Complexity: 323

Purity/Quality:

99% ^*data from raw suppliers

α-IsothipendylHydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(CN1C2=CC=CC=C2SC3=C1N=CC=C3)N(C)C.Cl
• Uses: Antihistaminic.
• Therapeutic Function: Antihistaminic