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

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

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

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

structure
  • CAS No:

    771509-82-1

  • Formula:

    C21H14ClN3O3S2

  • Chemical Name:

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

  • Synonyms:

    ZINC2629065;AKOS033478719;MCULE-5391293370;Z16255107;2-{[5-(2H-1,3-benzodioxol-5-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(5-chlorothiophen-2-yl)ethan-1-one;771509-82-1

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

455.9 g/mol

455.0165114 g/mol

Characteristics

120 Ų

Computed Properties

Molecular Weight:455.9
XLogP3:5.8
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:455.0165114
Monoisotopic Mass:455.0165114
Topological Polar Surface Area:120
Heavy Atom Count:30
Complexity:612
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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

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