3-[(5-nitropyridin-2-yl)amino]-1H-pyridine-2-thione

Base Information

• Chemical Name: 3-[(5-nitropyridin-2-yl)amino]-1H-pyridine-2-thione
• CAS No.: 65631-06-3
• Molecular Formula: C₁₀H₈N₄O₂S
• Molecular Weight: 248.265
• DSSTox Substance ID: DTXSID60392559
• Wikidata: Q82190899

Synonyms:AC1MQ98T;65631-06-3;Oprea1_043869;DTXSID60392559;2-mercapto-3-(5-nitro-2-pyridylamino)pyridine

Chemical Property of 3-[(5-nitropyridin-2-yl)amino]-1H-pyridine-2-thione

Chemical Property:

• XLogP3: 1.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 248.03679668
• Heavy Atom Count: 17
• Complexity: 388

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CNC(=S)C(=C1)NC2=NC=C(C=C2)[N+](=O)[O-]

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