3-(4-(4-(4-Fluorobenzoyl)-1-Piperidinyl)Butyl)-2,4(1H,3H)-Quinazolinedione

Molecule SVG Image

Properties Simple | Detailed

Formula C24H26FN3O3
IUPAC Name 3-[4-[4-(4-fluorobenzoyl)-1-piperidyl]butyl]-1h-quinazoline-2,4-dione
Molecular Mass 423.480 g·mol−1
Heat of Formation -554.4 ± 16.7 kJ·mol−1
Dipole Moment 6.27 ± 1.08 D
Volume 496.94 Å 3
Surface Area 441.57 Å 2
HOMO Energy -8.89 ± 0.55 eV
LUMO Energy -0.89 ± eV
Point Group Symmetry C1
Synonyms
  • 3-(4-(4-(p-fluorobenzoyl)piperidino)butyl)-2,4(1h,3h)quinazolinedione
  • 3-[4-[4-(4-fluorobenzoyl)-1-piperidyl]butyl]-1h-quinazoline-2,4-dione
  • 3-[4-[4-(4-fluorobenzoyl)-1-piperidyl]butyl]-1h-quinazoline-2,4-quinone
  • 3-[4-[4-(4-fluorobenzoyl)piperidin-1-yl]butyl]-1h-quinazoline-2,4-dione
  • 3-[4-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]butyl]-1h-quinazoline-2,4-dione
  • 3-[4-[4-[(4-fluorophenyl)-oxomethyl]-1-piperidinyl]butyl]-1h-quinazoline-2,4-dione
  • butanserin
  • butanserina [spanish]
  • butanserinum [latin]
  • pdsp1_000836
  • pdsp2_000823
  • r 53393
CAS Number(s)
  • 87051-46-5
InChIKey MLDQSYUQSLUEPG-UHFFFAOYSA-N
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