2-Hydroxy-4-[(pyridine-4-carbonylamino)carbamothioylamino]benzoic acid

Base Information

• Chemical Name: 2-Hydroxy-4-[(pyridine-4-carbonylamino)carbamothioylamino]benzoic acid
• CAS No.: 7400-69-3
• Molecular Formula: C14H12N4O4S
• Molecular Weight: 332.3345
• NSC Number: 34781
• DSSTox Substance ID: DTXSID50396021
• ChEMBL ID: CHEMBL1723168

Synonyms:NSC34781;MLS002607897;7400-69-3;CHEMBL1723168;DTXSID50396021;HMS3078H07;2-hydroxy-4-[(pyridine-4-carbonylamino)carbamothioylamino]benzoic acid;NSC-34781;SMR001526659;2-Hydroxy-4-{[(2-isonicotinoylhydrazino)carbonothioyl]amino}benzoic acid

Chemical Property of 2-Hydroxy-4-[(pyridine-4-carbonylamino)carbamothioylamino]benzoic acid

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: 1.57g/cm³
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 332.05792605
• Heavy Atom Count: 23
• Complexity: 456

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C=C1NC(=S)NNC(=O)C2=CC=NC=C2)O)C(=O)O

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