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Home > Encyclopedia > [3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 3-chloro-1-benzothiophene-2-carboxylate

[3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 3-chloro-1-benzothiophene-2-carboxylate

[3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 3-chloro-1-benzothiophene-2-carboxylate structure

[3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 3-chloro-1-benzothiophene-2-carboxylate 

structure
  • CAS No:

    380445-44-3

  • Formula:

    C20H12ClN3O3S

  • Chemical Name:

    [3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 3-chloro-1-benzothiophene-2-carboxylate

  • Synonyms:

    ZINC6147392;Z18785482;3-cyano-3-(2,3-dihydro-1H-1,3-benzodiazol-2-ylidene)-2-oxopropyl 3-chloro-1-benzothiophene-2-carboxylate;380445-44-3

[3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 3-chloro-1-benzothiophene-2-carboxylate Basic Attributes

409.8 g/mol

409.0287901 g/mol

Characteristics

127 Ų

Computed Properties

Molecular Weight:409.8
XLogP3:4.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:409.0287901
Monoisotopic Mass:409.0287901
Topological Polar Surface Area:127
Heavy Atom Count:28
Complexity:693
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of [3-(1H-benzimidazol-2-yl)-3-cyano-2-hydroxyprop-2-enyl] 3-chloro-1-benzothiophene-2-carboxylate

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