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Home > Encyclopedia > ethyl 4-(1,3-benzodioxol-5-ylmethyl)-5-methyl-2-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]thiophene-3-carboxylate

ethyl 4-(1,3-benzodioxol-5-ylmethyl)-5-methyl-2-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]thiophene-3-carboxylate

ethyl 4-(1,3-benzodioxol-5-ylmethyl)-5-methyl-2-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]thiophene-3-carboxylate structure

ethyl 4-(1,3-benzodioxol-5-ylmethyl)-5-methyl-2-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]thiophene-3-carboxylate 

structure
  • CAS No:

    750619-00-2

  • Formula:

    C21H22N4O5S2

  • Chemical Name:

    ethyl 4-(1,3-benzodioxol-5-ylmethyl)-5-methyl-2-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]thiophene-3-carboxylate

  • Synonyms:

    ZINC3271541;AKOS034461545;MCULE-1869556824;Z56856082;750619-00-2;ethyl 4-[(2H-1,3-benzodioxol-5-yl)methyl]-5-methyl-2-{2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamido}thiophene-3-carboxylate

ethyl 4-(1,3-benzodioxol-5-ylmethyl)-5-methyl-2-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]thiophene-3-carboxylate Basic Attributes

474.6 g/mol

474.10316216 g/mol

Characteristics

158 Ų

Computed Properties

Molecular Weight:474.6
XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:9
Exact Mass:474.10316216
Monoisotopic Mass:474.10316216
Topological Polar Surface Area:158
Heavy Atom Count:32
Complexity:674
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of ethyl 4-(1,3-benzodioxol-5-ylmethyl)-5-methyl-2-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]thiophene-3-carboxylate

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