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

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

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

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

structure
  • CAS No:

    757226-82-7

  • Formula:

    C25H21N3O4S

  • Chemical Name:

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

  • Synonyms:

    ZINC2619359;AKOS033478555;MCULE-3354279648;Z16254035;1-[3-({[5-(2H-1,3-benzodioxol-5-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-4-methoxyphenyl]ethan-1-one;757226-82-7

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

459.5 g/mol

459.12527733 g/mol

Characteristics

101 Ų

Computed Properties

Molecular Weight:459.5
XLogP3:4.6
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:459.12527733
Monoisotopic Mass:459.12527733
Topological Polar Surface Area:101
Heavy Atom Count:33
Complexity:664
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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

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