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Home > Encyclopedia > ethyl 2-[[(E)-2-cyano-3-[2-(difluoromethoxy)phenyl]prop-2-enoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

ethyl 2-[[(E)-2-cyano-3-[2-(difluoromethoxy)phenyl]prop-2-enoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

ethyl 2-[[(E)-2-cyano-3-[2-(difluoromethoxy)phenyl]prop-2-enoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate structure

ethyl 2-[[(E)-2-cyano-3-[2-(difluoromethoxy)phenyl]prop-2-enoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate 

structure
  • CAS No:

    488854-77-9

  • Formula:

    C22H20F2N2O4S

  • Chemical Name:

    ethyl 2-[[(E)-2-cyano-3-[2-(difluoromethoxy)phenyl]prop-2-enoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

  • Synonyms:

    C22H20F2N2O4S;ZINC1455632;STK740178;AKOS002187011;ST50077931;488854-77-9;ethyl 2-({(2E)-2-cyano-3-[2-(difluoromethoxy)phenyl]prop-2-enoyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate;ethyl 2-{(2E)-3-[2-(difluoromethoxy)phenyl]-2-cyanoprop-2-enoylamino}-4,5,6,7- tetrahydrobenzo[b]thiophene-3-carboxylate

ethyl 2-[[(E)-2-cyano-3-[2-(difluoromethoxy)phenyl]prop-2-enoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Basic Attributes

446.5 g/mol

446.11118462 g/mol

Characteristics

117 Ų

Computed Properties

Molecular Weight:446.5
XLogP3:6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:8
Exact Mass:446.11118462
Monoisotopic Mass:446.11118462
Topological Polar Surface Area:117
Heavy Atom Count:31
Complexity:738
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of ethyl 2-[[(E)-2-cyano-3-[2-(difluoromethoxy)phenyl]prop-2-enoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

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