Cas no 64487-94-1 (N-[2-(Diphenylmethoxy)ethyl]-2,3,6,7-tetrahydro-N,N,1,3-tetramethyl-2,6-dioxo-1H-purin-8-aminium Inner Salt)

N-[2-(Diphenylmethoxy)ethyl]-2,3,6,7-tetrahydro-N,N,1,3-tetramethyl-2,6-dioxo-1H-purin-8-aminium Inner Salt structure
64487-94-1 structure
Product Name:N-[2-(Diphenylmethoxy)ethyl]-2,3,6,7-tetrahydro-N,N,1,3-tetramethyl-2,6-dioxo-1H-purin-8-aminium Inner Salt
CAS No:64487-94-1
MF:C24H27N5O3
MW:433.502885103226
CID:1064896
PubChem ID:5256129
Update Time:2025-04-20

N-[2-(Diphenylmethoxy)ethyl]-2,3,6,7-tetrahydro-N,N,1,3-tetramethyl-2,6-dioxo-1H-purin-8-aminium Inner Salt Chemical and Physical Properties

Names and Identifiers

    • N-[2-(Diphenylmethoxy)ethyl]-2,3,6,7-tetrahydro-N,N,1,3-tetramethyl-2,6-dioxo-1H-purin-8-aminium Inner Salt
    • N-[2-(Diphenylmethoxy)ethyl]-2,3,6,7-tetrahydro-N,N,1,3-tetramethyl-2,6-dioxo-1H-purin-8-aminium Inn
    • 8-{[2-(Diphenylmethoxy)ethyl](dimethyl)ammonio}-1,3-dimethyl-2-ox o-2,3-dihydro-1H-purin-6-olate
    • N-[2-(Diphenylmethoxy)ethyl]-2,3,6,7-tetrahydro-N,N,1,3-tetramethyl-2,6-dioxo-1H-purin-8-aminium Inner Salt Discontinued
    • 8-[N-(2-Diphenylmethoxyethyl)-N,N-dimethylaminium]-1,3-dimet
    • 64487-94-1
    • 8-[N-(2-Diphenylmethoxyethyl)-N,N-dimethylaminium]-1,3-dimethylxanthine inner salt
    • 8-[2-benzhydryloxyethyl(dimethyl)azaniumyl]-1,3-dimethyl-2-oxopurin-6-olate
    • Inchi： 1S/C24H27N5O3/c1-27-21-19(22(30)28(2)24(27)31)25-23(26-21)29(3,4)15-16-32-20(17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14,20H,15-16H2,1-4H3
    • InChI Key： NDLAELDZJPCANE-UHFFFAOYSA-N
    • SMILES： O(C(C1C=CC=CC=1)C1C=CC=CC=1)CC[N+](C)(C)C1=NC2=C(N(C)C(N(C)C2=N1)=O)[O-]

Computed Properties

  • Exact Mass: 433.21138974g/mol
  • Monoisotopic Mass: 433.21138974g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 32
  • Rotatable Bond Count: 7
  • Complexity: 789
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.1
  • Topological Polar Surface Area: 80.6?2

N-[2-(Diphenylmethoxy)ethyl]-2,3,6,7-tetrahydro-N,N,1,3-tetramethyl-2,6-dioxo-1H-purin-8-aminium Inner Salt Related Literature

Related Categories

64487-94-1 (N-[2-(Diphenylmethoxy)ethyl]-2,3,6,7-tetrahydro-N,N,1,3-tetramethyl-2,6-dioxo-1H-purin-8-aminium Inner Salt) Related Products

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