2-Sulfanylidene-1,3-dihydrobenzimidazole-5-carboxamide

Base Information

• Chemical Name: 2-Sulfanylidene-1,3-dihydrobenzimidazole-5-carboxamide
• CAS No.: 121690-16-2
• Molecular Formula: C8H7 N3 O S
• Molecular Weight: 193.23
• DSSTox Substance ID: DTXSID30592882
• Wikidata: Q82487233
• Mol file: 121690-16-2.mol

Synonyms:121690-16-2;2-sulfanylidene-1,3-dihydrobenzimidazole-5-carboxamide;1H-Benzimidazole-5-carboxamide,2,3-dihydro-2-thioxo-(9CI);SCHEMBL7868231;SCHEMBL16134556;DTXSID30592882;AKOS006303132;2-Sulfanylidene-2,3-dihydro-1H-benzimidazole-5-carboxamide;2-Thioxo-2,3-dihydro-1H-benzo[d]imidazole-5-carboxamide

Chemical Property of 2-Sulfanylidene-1,3-dihydrobenzimidazole-5-carboxamide

Chemical Property:

• PSA: 111.56000
• LogP: 1.83470
• XLogP3: 0
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 193.03098303
• Heavy Atom Count: 13
• Complexity: 256

Purity/Quality:

2,3-DIHYDRO-2-THIOXO-1H-BENZIMIDAZOLE-5-CARBOXAMIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C(C=C1C(=O)N)NC(=S)N2

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