5-[(3-Benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1-butyl-4-methyl-6-(3-methylpiperidin-1-yl)-2-oxopyridine-3-carbonitrile

Base Information

• Chemical Name: 5-[(3-Benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1-butyl-4-methyl-6-(3-methylpiperidin-1-yl)-2-oxopyridine-3-carbonitrile
• CAS No.: 7064-94-0
• Molecular Formula: C7H7 N2 S . Br
• Molecular Weight: 520.7093
• DSSTox Substance ID: DTXSID70414519

Synonyms:7064-94-0;AC1NRGKG;DTXSID70414519

Chemical Property of 5-[(3-Benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1-butyl-4-methyl-6-(3-methylpiperidin-1-yl)-2-oxopyridine-3-carbonitrile

Chemical Property:

• Vapor Pressure: 5.21E-12mmHg at 25°C
• Boiling Point: 546.8°C at 760 mmHg
• Flash Point: 284.5°C
• Density: 1.31g/cm³
• XLogP3: 5.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 7
• Exact Mass: 520.19666862
• Heavy Atom Count: 36
• Complexity: 1060

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCN1C(=C(C(=C(C1=O)C#N)C)C=C2C(=O)N(C(=S)S2)CC3=CC=CC=C3)N4CCCC(C4)C

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