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

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

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

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

structure
  • CAS No:

    804496-11-5

  • Formula:

    C24H19N3O4S

  • Chemical Name:

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

  • Synonyms:

    ZINC3345720;AKOS033478629;MCULE-1270162286;Z16254711;804496-11-5;methyl 4-({[5-(2H-1,3-benzodioxol-5-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzoate

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

445.5 g/mol

445.10962727 g/mol

Characteristics

101 Ų

Computed Properties

Molecular Weight:445.5
XLogP3:4.8
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:445.10962727
Monoisotopic Mass:445.10962727
Topological Polar Surface Area:101
Heavy Atom Count:32
Complexity:626
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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

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