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Home > Encyclopedia > methyl 4-[[5-(4,5,6,7-tetrahydro-1-benzothiophene-2-carbonylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzoate

methyl 4-[[5-(4,5,6,7-tetrahydro-1-benzothiophene-2-carbonylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzoate

methyl 4-[[5-(4,5,6,7-tetrahydro-1-benzothiophene-2-carbonylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzoate structure

methyl 4-[[5-(4,5,6,7-tetrahydro-1-benzothiophene-2-carbonylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzoate 

structure
  • CAS No:

    786721-84-4

  • Formula:

    C20H19N3O3S3

  • Chemical Name:

    methyl 4-[[5-(4,5,6,7-tetrahydro-1-benzothiophene-2-carbonylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzoate

  • Synonyms:

    SMR000153827;MLS000567043;MLS002635384;CHEMBL1497679;HMS2171N05;HMS3325C06;ZINC3369353;AKOS034010422;MCULE-7925221167;Z27481587;786721-84-4;methyl 4-({[5-(4,5,6,7-tetrahydro-1-benzothiophene-2-amido)-1,3,4-thiadiazol-2-yl]sulfanyl}methyl)benzoate

methyl 4-[[5-(4,5,6,7-tetrahydro-1-benzothiophene-2-carbonylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzoate Basic Attributes

445.6 g/mol

445.05885500 g/mol

Characteristics

163 Ų

Computed Properties

Molecular Weight:445.6
XLogP3:5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:7
Exact Mass:445.05885500
Monoisotopic Mass:445.05885500
Topological Polar Surface Area:163
Heavy Atom Count:29
Complexity:589
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of methyl 4-[[5-(4,5,6,7-tetrahydro-1-benzothiophene-2-carbonylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzoate

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