5-Ethyl-5-Phenyl-1,3-Bis(1-Piperidinylmethyl)-2,4,6(1H,3H,5H)-Pyrimidinetrione

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Properties Simple | Detailed

Formula C24H34N4O3
IUPAC Name 5-ethyl-5-phenyl-1,3-bis(1-piperidylmethyl)hexahydropyrimidine-2,4,6-trione
Molecular Mass 426.552 g·mol−1
Heat of Formation -490.4 ± 16.7 kJ·mol−1
Dipole Moment 0.87 ± 1.08 D
Volume 530.51 Å 3
Surface Area 404.99 Å 2
HOMO Energy -8.81 ± 0.55 eV
LUMO Energy -0.14 ± eV
Point Group Symmetry C1
Synonyms
  • 1,3-bis(piperidinomethyl)-5-ethyl-5-phenylbarbituric acid
  • 1,3-bis-(piperidinomethyl-5-ethyl-5-phenylbarbituric acid)
  • 1,3-bpp
  • 2,4,6(1h,3h,5h)-pyrimidinetrione, 5-ethyl-5-phenyl-1,3-bis(1-piperidinylmethyl)- (9ci)
  • 5-ethyl-5-phenyl-1,3-bis(piperidin-1-ylmethyl)-1,3-diazinane-2,4,6-trione
  • 5-ethyl-5-phenyl-1,3-bis(piperidinomethyl)barbituric acid
  • barbituric acid, 1,3-bis(piperidinomethyl)-5-ethyl-5-phenyl-
  • imet 176-68
  • imet 176/68
  • zimet 176/68
CAS Number(s)
  • 23192-91-8
InChIKey JDPUAECPKWLADB-UHFFFAOYSA-N
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