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Home > Encyclopedia > 13-benzylsulfanyl-4,4-dimethyl-8-(2-methylpropyl)-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaene

13-benzylsulfanyl-4,4-dimethyl-8-(2-methylpropyl)-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaene

13-benzylsulfanyl-4,4-dimethyl-8-(2-methylpropyl)-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaene structure

13-benzylsulfanyl-4,4-dimethyl-8-(2-methylpropyl)-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaene 

structure
  • CAS No:

    672272-72-9

  • Formula:

    C25H27N3OS2

  • Chemical Name:

    13-benzylsulfanyl-4,4-dimethyl-8-(2-methylpropyl)-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaene

  • Synonyms:

    Oprea1_098764;ZINC1800327;STK540829;AKOS005470838;MCULE-4209468006;672272-72-9;8-(benzylsulfanyl)-2,2-dimethyl-5-(2-methylpropyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine

13-benzylsulfanyl-4,4-dimethyl-8-(2-methylpropyl)-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaene Basic Attributes

449.6 g/mol

449.15955484 g/mol

Characteristics

101 Ų

Computed Properties

Molecular Weight:449.6
XLogP3:6.2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:449.15955484
Monoisotopic Mass:449.15955484
Topological Polar Surface Area:101
Heavy Atom Count:31
Complexity:612
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 13-benzylsulfanyl-4,4-dimethyl-8-(2-methylpropyl)-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaene

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