3-{[(4-Methoxyphenyl)methyl]sulfanyl}quinoline-2-carbonitrile

Base Information

• Chemical Name: 3-{[(4-Methoxyphenyl)methyl]sulfanyl}quinoline-2-carbonitrile
• CAS No.: 61830-16-8
• Molecular Formula: C18H14N2OS
• DSSTox Substance ID: DTXSID20494083
• Wikidata: Q82341193

Synonyms:61830-16-8;DTXSID20494083;3-{[(4-Methoxyphenyl)methyl]sulfanyl}quinoline-2-carbonitrile

Chemical Property of 3-{[(4-Methoxyphenyl)methyl]sulfanyl}quinoline-2-carbonitrile

Chemical Property:

• XLogP3: 4.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 306.08268425
• Heavy Atom Count: 22
• Complexity: 399

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)CSC2=CC3=CC=CC=C3N=C2C#N

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