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Home > Encyclopedia > 3-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-7-(2-phenylethyl)-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one

3-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-7-(2-phenylethyl)-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one

3-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-7-(2-phenylethyl)-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one structure

3-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-7-(2-phenylethyl)-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one 

structure
  • CAS No:

    488708-28-7

  • Formula:

    C27H23FN4O2S2

  • Chemical Name:

    3-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-7-(2-phenylethyl)-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one

  • Synonyms:

    ZINC1822929;STK829825;AKOS001490954;MCULE-6390311936;1-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-4-(2-phenylethyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one;1-{[2-(4-fluorophenyl)-2-oxoethyl]thio}-4-(2-phenylethyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one;488708-28-7

3-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-7-(2-phenylethyl)-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one Basic Attributes

518.6 g/mol

518.12464650 g/mol

Characteristics

122 Ų

Computed Properties

Molecular Weight:518.6
XLogP3:6.1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:518.12464650
Monoisotopic Mass:518.12464650
Topological Polar Surface Area:122
Heavy Atom Count:36
Complexity:807
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 3-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-7-(2-phenylethyl)-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one

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