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Home > Encyclopedia > 2-[[5-(1,3-benzodioxol-5-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-cyanoethyl)-N-(4-methylphenyl)acetamide

2-[[5-(1,3-benzodioxol-5-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-cyanoethyl)-N-(4-methylphenyl)acetamide

2-[[5-(1,3-benzodioxol-5-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-cyanoethyl)-N-(4-methylphenyl)acetamide structure

2-[[5-(1,3-benzodioxol-5-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-cyanoethyl)-N-(4-methylphenyl)acetamide 

structure
  • CAS No:

    762250-11-3

  • Formula:

    C27H23N5O3S

  • Chemical Name:

    2-[[5-(1,3-benzodioxol-5-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-cyanoethyl)-N-(4-methylphenyl)acetamide

  • Synonyms:

    ZINC2623023;AKOS033478537;MCULE-5791531823;Z16253893;2-{[5-(2H-1,3-benzodioxol-5-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-cyanoethyl)-N-(4-methylphenyl)acetamide;762250-11-3

2-[[5-(1,3-benzodioxol-5-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-cyanoethyl)-N-(4-methylphenyl)acetamide Basic Attributes

497.6 g/mol

497.15216079 g/mol

Characteristics

119 Ų

Computed Properties

Molecular Weight:497.6
XLogP3:4.5
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:497.15216079
Monoisotopic Mass:497.15216079
Topological Polar Surface Area:119
Heavy Atom Count:36
Complexity:779
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]-N-(2-cyanoethyl)-N-(4-methylphenyl)acetamide

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