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Home > Encyclopedia > [2-(3-cyanoanilino)-2-oxoethyl] 4-(1,3-benzothiazol-2-yl)butanoate

[2-(3-cyanoanilino)-2-oxoethyl] 4-(1,3-benzothiazol-2-yl)butanoate

[2-(3-cyanoanilino)-2-oxoethyl] 4-(1,3-benzothiazol-2-yl)butanoate structure

[2-(3-cyanoanilino)-2-oxoethyl] 4-(1,3-benzothiazol-2-yl)butanoate 

structure
  • CAS No:

    733025-57-5

  • Formula:

    C20H17N3O3S

  • Chemical Name:

    [2-(3-cyanoanilino)-2-oxoethyl] 4-(1,3-benzothiazol-2-yl)butanoate

  • Synonyms:

    ZINC3318655;AKOS033742431;MCULE-6461164870;AB00718041-01;Z20277297;[(3-cyanophenyl)carbamoyl]methyl 4-(1,3-benzothiazol-2-yl)butanoate;733025-57-5

[2-(3-cyanoanilino)-2-oxoethyl] 4-(1,3-benzothiazol-2-yl)butanoate Basic Attributes

379.4 g/mol

379.09906259 g/mol

Characteristics

120 Ų

Computed Properties

Molecular Weight:379.4
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:379.09906259
Monoisotopic Mass:379.09906259
Topological Polar Surface Area:120
Heavy Atom Count:27
Complexity:576
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of [2-(3-cyanoanilino)-2-oxoethyl] 4-(1,3-benzothiazol-2-yl)butanoate

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