3,5-Diamino-N-[Amino-(Phenylamino)Methylidene]-6-Chloropyrazine-2-Carboxamide
[CAS# 2038-35-9]

Identification

• Name: 3,5-Diamino-N-[Amino-(Phenylamino)Methylidene]-6-Chloropyrazine-2-Carboxamide
• Synonyms: 3,5-Diamino-N-[Amino-(Phenylamino)Methylene]-6-Chloro-Pyrazine-2-Carboxamide; 3,5-Diamino-N-[Amino-(Phenylamino)Methylene]-6-Chloro-2-Pyrazinecarboxamide; 3,5-Diamino-N-[Amino-(Phenylamino)Methylene]-6-Chloro-Pyrazinamide
• Molecular Formula: C₁₂H₁₂ClN₇O
• Molecular Weight: 305.73
• CAS Registry Number: 2038-35-9
• SMILES: C2=C(NC(=NC(=O)C1=C(N=C(N)C(=N1)Cl)N)N)C=CC=C2
• InChI: 1S/C12H12ClN7O/c13-8-10(15)19-9(14)7(18-8)11(21)20-12(16)17-6-4-2-1-3-5-6/h1-5H,(H4,14,15,19)(H3,16,17,20,21)
• InChIKey: NIOHELZQFBGCEO-UHFFFAOYSA-N

Properties

• Density: 1.656g/cm³ (Cal.)
• Boiling point: 621.712°C at 760 mmHg (Cal.)
• Flash point: 329.8°C (Cal.)

References

• (1): Ye et al.. Cardiac glycosides are potent inhibitors of interferon-beta gene expression, Nature Chemical Biology, 2010