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Home > Encyclopedia > 4-(1,3-benzodioxol-5-yl)-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene

4-(1,3-benzodioxol-5-yl)-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene

4-(1,3-benzodioxol-5-yl)-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene structure

4-(1,3-benzodioxol-5-yl)-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene 

structure
  • CAS No:

    878441-87-3

  • Formula:

    C18H14N4O2S

  • Chemical Name:

    4-(1,3-benzodioxol-5-yl)-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene

  • Synonyms:

    ZINC2436075;STK785080;AKOS000585361;MCULE-9841767385;2-(1,3-benzodioxol-5-yl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine;878441-87-3

4-(1,3-benzodioxol-5-yl)-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene Basic Attributes

350.4 g/mol

350.08374688 g/mol

Characteristics

89.8 Ų

Computed Properties

Molecular Weight:350.4
XLogP3:4.2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:350.08374688
Monoisotopic Mass:350.08374688
Topological Polar Surface Area:89.8
Heavy Atom Count:25
Complexity:525
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 4-(1,3-benzodioxol-5-yl)-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene

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