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Home > Encyclopedia > 6-(4-chlorophenyl)-2-[[3-(trifluoromethyl)phenoxy]methyl]-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene

6-(4-chlorophenyl)-2-[[3-(trifluoromethyl)phenoxy]methyl]-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene

6-(4-chlorophenyl)-2-[[3-(trifluoromethyl)phenoxy]methyl]-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene structure

6-(4-chlorophenyl)-2-[[3-(trifluoromethyl)phenoxy]methyl]-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene 

structure
  • CAS No:

    757221-80-0

  • Formula:

    C23H19ClF3N3O

  • Chemical Name:

    6-(4-chlorophenyl)-2-[[3-(trifluoromethyl)phenoxy]methyl]-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene

  • Synonyms:

    ZINC2619160;AKOS034470050;MCULE-6186854444;Z57000608;6-(4-chlorophenyl)-2-{[3-(trifluoromethyl)phenoxy]methyl}-1,3,4-triazatricyclo[5.4.1.0^{4,12}]dodeca-2,5,7(12)-triene;757221-80-0

6-(4-chlorophenyl)-2-[[3-(trifluoromethyl)phenoxy]methyl]-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene Basic Attributes

445.9 g/mol

445.1168744 g/mol

Characteristics

31.5 Ų

Computed Properties

Molecular Weight:445.9
XLogP3:5.9
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:445.1168744
Monoisotopic Mass:445.1168744
Topological Polar Surface Area:31.5
Heavy Atom Count:31
Complexity:615
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 6-(4-chlorophenyl)-2-[[3-(trifluoromethyl)phenoxy]methyl]-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene

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