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Home > Encyclopedia > 7-(3-chlorophenyl)-12,12-dimethyl-3-phenacylsulfanyl-13-oxa-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one

7-(3-chlorophenyl)-12,12-dimethyl-3-phenacylsulfanyl-13-oxa-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one

7-(3-chlorophenyl)-12,12-dimethyl-3-phenacylsulfanyl-13-oxa-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

7-(3-chlorophenyl)-12,12-dimethyl-3-phenacylsulfanyl-13-oxa-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:

    840483-50-3

  • Formula:

    C26H21ClN4O3S2

  • Chemical Name:

    7-(3-chlorophenyl)-12,12-dimethyl-3-phenacylsulfanyl-13-oxa-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:

    ZINC2264478;STK554877;AKOS005481242;MCULE-6752916407;4-(3-chlorophenyl)-7,7-dimethyl-1-((2-oxo-2-phenylethyl)thio)-6,7-dihydro-4H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(9H)-one;4-(3-chlorophenyl)-7,7-dimethyl-1-[(2-oxo-2-phenylethyl)sulfanyl]-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one;840483-50-3

7-(3-chlorophenyl)-12,12-dimethyl-3-phenacylsulfanyl-13-oxa-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

537.1 g/mol

536.0743606 g/mol

Characteristics

131 Ų

Computed Properties

Molecular Weight:537.1
XLogP3:5.3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:536.0743606
Monoisotopic Mass:536.0743606
Topological Polar Surface Area:131
Heavy Atom Count:36
Complexity:859
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 7-(3-chlorophenyl)-12,12-dimethyl-3-phenacylsulfanyl-13-oxa-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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