Besulpamide

Base Information

• Chemical Name: Besulpamide
• CAS No.: 90992-25-9
• Molecular Formula: C15H16ClN3O3S
• Molecular Weight: 353.8238
• UNII: 048UJ2MM65
• DSSTox Substance ID: DTXSID40920016
• NCI Thesaurus Code: C74254
• ChEMBL ID: CHEMBL2106604
• Mol file: 90992-25-9.mol

Synonyms:1-(4-chloro-3-sulfamoylbenzamido)-2,4,6-trimethylpyridinium hydroxide, inner salt;besulpamide

Chemical Property of Besulpamide

Chemical Property:

• Melting Point: 255-257°C
• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 106.36000
• Density: g/cm³
• LogP: 4.64840
• Storage Temp.: Hygroscopic, -20°C Freezer, Under inert atmosphere
• Solubility.: Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly, Sonicated)
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 353.0600902
• Heavy Atom Count: 23
• Complexity: 537

Purity/Quality:

Besulpamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=[N+](C(=C1)C)N=C(C2=CC(=C(C=C2)Cl)S(=O)(=O)N)[O-])C
• Isomeric SMILES: CC1=CC(=[N+](C(=C1)C)/N=C(/C2=CC(=C(C=C2)Cl)S(=O)(=O)N)\[O-])C
• Uses: Besulpamide is an antihypertensive agent. It also exhibits diuretic activity in rats and dogs.

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