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

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

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

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

structure
  • CAS No:

    763095-59-6

  • Formula:

    C22H21N5O3S

  • Chemical Name:

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

  • Synonyms:

    ZINC2625596;AKOS033450428;MCULE-8272667059;AB00726135-01;Z15911190;2-({4-[(2H-1,3-benzodioxol-5-yl)methyl]-5-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-cyanoethyl)-N-methylacetamide;763095-59-6

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

435.5 g/mol

435.13651072 g/mol

Characteristics

119 Ų

Computed Properties

Molecular Weight:435.5
XLogP3:2.6
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:435.13651072
Monoisotopic Mass:435.13651072
Topological Polar Surface Area:119
Heavy Atom Count:31
Complexity:652
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 2-[[4-(1,3-benzodioxol-5-ylmethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-cyanoethyl)-N-methylacetamide

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