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

Base Information

• Chemical Name: 6-(4-Benzylpiperidin-1-yl)-5-[(3-butyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-4-methyl-2-oxo-1-propylpyridine-3-carbonitrile
• CAS No.: 7064-21-3
• Molecular Formula: C13H24 N O3 . I
• Molecular Weight: 548.7624
• DSSTox Substance ID: DTXSID40414425

Synonyms:7064-21-3;AC1NRE36;DTXSID40414425

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

Chemical Property:

• Vapor Pressure: 8.58E-13mmHg at 25°C
• Boiling Point: 565.1°Cat760mmHg
• Flash Point: 295.6°C
• Density: 1.27g/cm³
• XLogP3: 6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 9
• Exact Mass: 548.22796875
• Heavy Atom Count: 38
• Complexity: 1080

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: CCCCN1C(=O)C(=CC2=C(N(C(=O)C(=C2C)C#N)CCC)N3CCC(CC3)CC4=CC=CC=C4)SC1=S

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