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Home > Encyclopedia > 2-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-[1-(2-methoxyethyl)-2,5-dimethylpyrrol-3-yl]ethanone

2-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-[1-(2-methoxyethyl)-2,5-dimethylpyrrol-3-yl]ethanone

2-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-[1-(2-methoxyethyl)-2,5-dimethylpyrrol-3-yl]ethanone structure

2-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-[1-(2-methoxyethyl)-2,5-dimethylpyrrol-3-yl]ethanone 

structure
  • CAS No:

    782458-53-1

  • Formula:

    C21H26N4O2S

  • Chemical Name:

    2-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-[1-(2-methoxyethyl)-2,5-dimethylpyrrol-3-yl]ethanone

  • Synonyms:

    ZINC2626906;AKOS017017993;MCULE-3966155978;AB00726591-01;Z24541332;2-[(4-benzyl-5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]ethan-1-one;782458-53-1

2-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-[1-(2-methoxyethyl)-2,5-dimethylpyrrol-3-yl]ethanone Basic Attributes

398.5 g/mol

398.17764726 g/mol

Characteristics

87.2 Ų

Computed Properties

Molecular Weight:398.5
XLogP3:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:9
Exact Mass:398.17764726
Monoisotopic Mass:398.17764726
Topological Polar Surface Area:87.2
Heavy Atom Count:28
Complexity:503
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 2-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-[1-(2-methoxyethyl)-2,5-dimethylpyrrol-3-yl]ethanone

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