methyl N-cyano-N'-[(4-fluorophenyl)methyl]carbamimidothioate

Base Information

• Chemical Name: methyl N-cyano-N'-[(4-fluorophenyl)methyl]carbamimidothioate
• CAS No.: 87253-84-7
• Molecular Formula: C₁₀H₁₀FN₃S
• Molecular Weight: 223.274
• DSSTox Substance ID: DTXSID901185775

Synonyms:DTXSID901185775;methyl N-cyano-N'-[(4-fluorophenyl)methyl]carbamimidothioate;AKOS019053582;87253-84-7

Chemical Property of methyl N-cyano-N'-[(4-fluorophenyl)methyl]carbamimidothioate

Chemical Property:

• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 223.05794667
• Heavy Atom Count: 15
• Complexity: 263

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• Canonical SMILES: CSC(=NCC1=CC=C(C=C1)F)NC#N

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