Ezetimibe

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Properties Simple | Detailed

Formula C24H21F2NO3
IUPAC Name (3r,4s)-1-(4-fluorophenyl)-3-[(3s)-3-(4-fluorophenyl)-3-hydroxy-propyl]-4-(4-hydroxyphenyl)azetidin-2-one
Molecular Mass 409.425 g·mol−1
Heat of Formation -608.5 ± 16.7 kJ·mol−1
Dipole Moment 6.04 ± 1.08 D
Volume 475.37 Å 3
Surface Area 398.43 Å 2
HOMO Energy -8.61 ± 0.55 eV
LUMO Energy -0.59 ± eV
Point Group Symmetry C1
Synonyms
  • (-)-sch 58235
  • (3r,4s)-1-(4-fluorophenyl)-3-[(3s)-3-(4-fluorophenyl)-3-hydroxy-propyl]-4-(4-hydroxyphenyl)azetidin-2-one
  • (3r,4s)-1-(4-fluorophenyl)-3-[(3s)-3-(4-fluorophenyl)-3-hydroxypropyl]-4-(4-hydroxyphenyl)-2-azetidinone
  • (3r,4s)-1-(4-fluorophenyl)-3-[(3s)-3-(4-fluorophenyl)-3-hydroxypropyl]-4-(4-hydroxyphenyl)azetidin-2-one
  • 2-azetidinone, 1-(4-fluorophenyl)-3-((3s)-3-(4-fluorophenyl)-3-hydroxypropyl)-4-(4-hydroxyphenyl)-, (3r,4s)-
  • 2-azetidinone, 1-(4-fluorophenyl)-3-(3-(4-fluorophenyl)-3-hydroxypropyl)-4-(4-hydroxyphenyl)-, (3r-(3alpha(s*),4beta))-
  • d01966
  • ezedoc
  • ezetimibe (jan/usan)
  • ezetrol
  • ls-181801
  • mk-0653
  • sch 58235
  • sch-58235
  • zetia
  • zient
CAS Number(s)
  • 163222-33-1
InChIKey OLNTVTPDXPETLC-XPWALMASSA-N
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