2-(Methanesulfonyl)-1H-benzimidazole-4-carboxamide

Base Information

• Chemical Name: 2-(Methanesulfonyl)-1H-benzimidazole-4-carboxamide
• CAS No.: 636574-48-6
• Molecular Formula: C9H9N3O3S
• Molecular Weight: 239.25
• DSSTox Substance ID: DTXSID50472379
• Wikidata: Q82301285
• Mol file: 636574-48-6.mol

Synonyms:636574-48-6;2-(Methanesulfonyl)-1H-benzimidazole-4-carboxamide;1H-Benzimidazole-4-carboxamide,2-(methylsulfonyl)-;2-methylsulfonyl-1H-benzimidazole-4-carboxamide;2-(Methylsulfonyl)-1H-benzo[d]imidazole-4-carboxamide;SCHEMBL6836817;DTXSID50472379;FT-0757184

Chemical Property of 2-(Methanesulfonyl)-1H-benzimidazole-4-carboxamide

Chemical Property:

• PSA: 114.29000
• LogP: 1.84640
• XLogP3: -0.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 239.03646233
• Heavy Atom Count: 16
• Complexity: 389

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CS(=O)(=O)C1=NC2=C(C=CC=C2N1)C(=O)N