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Home > Encyclopedia > 3-[(2,4-dichlorophenyl)methylsulfanyl]-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-dichlorophenyl)methylsulfanyl]-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-dichlorophenyl)methylsulfanyl]-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-dichlorophenyl)methylsulfanyl]-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:

    498538-04-8

  • Formula:

    C26H22Cl2N4OS2

  • Chemical Name:

    3-[(2,4-dichlorophenyl)methylsulfanyl]-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:

    C26H22Cl2N4OS2;ZINC1813513;STK543923;AKOS005473240;MCULE-2686368047;1-[(2,4-dichlorobenzyl)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;498538-04-8

3-[(2,4-dichlorophenyl)methylsulfanyl]-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

541.5 g/mol

540.0612091 g/mol

Characteristics

105 Ų

Computed Properties

Molecular Weight:541.5
XLogP3:7.3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:540.0612091
Monoisotopic Mass:540.0612091
Topological Polar Surface Area:105
Heavy Atom Count:35
Complexity:759
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 3-[(2,4-dichlorophenyl)methylsulfanyl]-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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