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Home > Encyclopedia > [2-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxoethyl] quinoline-2-carboxylate

[2-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxoethyl] quinoline-2-carboxylate

[2-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxoethyl] quinoline-2-carboxylate structure

[2-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxoethyl] quinoline-2-carboxylate 

structure
  • CAS No:

    571940-79-9

  • Formula:

    C22H19N3O3S

  • Chemical Name:

    [2-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxoethyl] quinoline-2-carboxylate

  • Synonyms:

    ZINC2627154;AKOS033702415;MCULE-2564811429;Z19716002;({3-cyano-4H,5H,6H,7H,8H-cyclohepta[b]thiophen-2-yl}carbamoyl)methyl quinoline-2-carboxylate;571940-79-9

[2-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxoethyl] quinoline-2-carboxylate Basic Attributes

405.5 g/mol

405.11471265 g/mol

Characteristics

120 Ų

Computed Properties

Molecular Weight:405.5
XLogP3:5.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:405.11471265
Monoisotopic Mass:405.11471265
Topological Polar Surface Area:120
Heavy Atom Count:29
Complexity:663
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of [2-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxoethyl] quinoline-2-carboxylate

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