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Home > Encyclopedia > 4-[[4-(1,3-benzodioxol-5-ylmethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile

4-[[4-(1,3-benzodioxol-5-ylmethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile

4-[[4-(1,3-benzodioxol-5-ylmethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile structure

4-[[4-(1,3-benzodioxol-5-ylmethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile 

structure
  • CAS No:

    565207-64-9

  • Formula:

    C24H18N4O2S

  • Chemical Name:

    4-[[4-(1,3-benzodioxol-5-ylmethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile

  • Synonyms:

    ZINC3338761;AKOS000825405;MCULE-1091160774;Z15911846;4-[({4-[(2H-1,3-benzodioxol-5-yl)methyl]-5-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]benzonitrile;565207-64-9

4-[[4-(1,3-benzodioxol-5-ylmethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile Basic Attributes

426.5 g/mol

426.11504700 g/mol

Characteristics

98.3 Ų

Computed Properties

Molecular Weight:426.5
XLogP3:4.6
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:426.11504700
Monoisotopic Mass:426.11504700
Topological Polar Surface Area:98.3
Heavy Atom Count:31
Complexity:628
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 4-[[4-(1,3-benzodioxol-5-ylmethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile

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