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Home > Encyclopedia > 3-(3-methylbutylsulfanyl)-7-(2-methylphenyl)-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-(3-methylbutylsulfanyl)-7-(2-methylphenyl)-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-(3-methylbutylsulfanyl)-7-(2-methylphenyl)-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-(3-methylbutylsulfanyl)-7-(2-methylphenyl)-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:

    383371-81-1

  • Formula:

    C23H26N4OS2

  • Chemical Name:

    3-(3-methylbutylsulfanyl)-7-(2-methylphenyl)-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:

    ZINC2309312;STK835788;AKOS005624048;MCULE-3313928530;1-[(3-methylbutyl)sulfanyl]-4-(2-methylphenyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one;383371-81-1

3-(3-methylbutylsulfanyl)-7-(2-methylphenyl)-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

438.6 g/mol

438.15480381 g/mol

Characteristics

105 Ų

Computed Properties

Molecular Weight:438.6
XLogP3:6.2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:438.15480381
Monoisotopic Mass:438.15480381
Topological Polar Surface Area:105
Heavy Atom Count:30
Complexity:634
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 3-(3-methylbutylsulfanyl)-7-(2-methylphenyl)-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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