Bifeprunox

Molecule SVG Image

Properties Simple | Detailed

Formula C24H23N3O2
IUPAC Name 7-[4-[(3-phenylphenyl)methyl]piperazin-1-yl]-3h-1,3-benzoxazol-2-one
Molecular Mass 385.458 g·mol−1
Heat of Formation 67.1 ± 16.7 kJ·mol−1
Dipole Moment 3.16 ± 1.08 D
Volume 461.04 Å 3
Surface Area 400.51 Å 2
HOMO Energy -8.40 ± 0.55 eV
LUMO Energy -0.25 ± eV
Point Group Symmetry C1
Synonyms
  • 7-(4-(biphenyl-3-ylmethyl)piperazin-1-yl)benzoxazol-2(3h)-one
  • 7-[4-(3-phenylbenzyl)piperazin-1-yl]-3h-1,3-benzoxazol-2-one
  • 7-[4-[(3-phenylphenyl)methyl]-1-piperazinyl]-3h-1,3-benzoxazol-2-one
  • 7-[4-[(3-phenylphenyl)methyl]piperazin-1-yl]-3h-1,3-benzoxazol-2-one
  • bifeprunox (usan)
  • d06566
  • du127090
CAS Number(s)
  • 350992-10-8
InChIKey CYGODHVAJQTCBG-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N