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Home > Encyclopedia > ethyl 6-amino-4-[4-(tert-butyl)phenyl]-5-cyano-2-{[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)sulfanyl]methyl}-4H-pyran-3-carboxylate

ethyl 6-amino-4-[4-(tert-butyl)phenyl]-5-cyano-2-{[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)sulfanyl]methyl}-4H-pyran-3-carboxylate

ethyl 6-amino-4-[4-(tert-butyl)phenyl]-5-cyano-2-{[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)sulfanyl]methyl}-4H-pyran-3-carboxylate structure

ethyl 6-amino-4-[4-(tert-butyl)phenyl]-5-cyano-2-{[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)sulfanyl]methyl}-4H-pyran-3-carboxylate 

structure
  • CAS No:

    445384-33-8

  • Formula:

    C31H34N4O3S

  • Chemical Name:

    ethyl 6-amino-4-[4-(tert-butyl)phenyl]-5-cyano-2-{[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)sulfanyl]methyl}-4H-pyran-3-carboxylate

  • Synonyms:

    ethyl 6-amino-4-(4-tert-butylphenyl)-5-cyano-2-[({3-cyano-5H,6H,7H,8H,9H-cyclohepta[b]pyridin-2-yl}sulfanyl)methyl]-4H-pyran-3-carboxylate;ethyl 6-amino-4-(4-tert-butylphenyl)-5-cyano-2-{[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)sulfanyl]methyl}-4H-pyran-3-carboxylate;AM-807/14957205;KS-00003RZ3;STL334822;AKOS003598333;MCULE-2716726947;SS-0544;ethyl 6-amino-4-[4-(tert-butyl)phenyl]-5-cyano-2-{[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)sulfanyl]methyl}-4H-pyran-3-carboxylate

ethyl 6-amino-4-[4-(tert-butyl)phenyl]-5-cyano-2-{[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)sulfanyl]methyl}-4H-pyran-3-carboxylate Basic Attributes

542.69166

542.235

Characteristics

147

6.5

Computed Properties

Molecular Weight:542.7
XLogP3:6.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:8
Exact Mass:542.23516213
Monoisotopic Mass:542.23516213
Topological Polar Surface Area:147
Heavy Atom Count:39
Complexity:1070
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of ethyl 6-amino-4-[4-(tert-butyl)phenyl]-5-cyano-2-{[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)sulfanyl]methyl}-4H-pyran-3-carboxylate

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