Ravuconazole

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Properties Simple | Detailed

Formula C22H17F2N5OS
IUPAC Name 4-[2-[(1r,2r)-3-(4-aza-1-azonia-2-azanidacyclopenta-3,5-dien-1-yl)-2-(2,4-difluorophenyl)-2-hydroxy-1-methyl-propyl]thiazol-4-yl]benzonitrile
Molecular Mass 437.465 g·mol−1
Heat of Formation 63.1 ± 16.7 kJ·mol−1
Dipole Moment 5.75 ± 1.08 D
Volume 489.0 Å 3
Surface Area 403.11 Å 2
HOMO Energy -9.28 ± 0.55 eV
LUMO Energy 1.62 ± eV
Point Group Symmetry C1
Synonyms
  • 4-[2-[(1r,2r)-2-(2,4-difluorophenyl)-2-hydroxy-1-methyl-3-(1,2,4-triazol-1-yl)propyl]-4-thiazolyl]benzonitrile
  • 4-[2-[(1r,2r)-2-(2,4-difluorophenyl)-2-hydroxy-1-methyl-3-(1,2,4-triazol-1-yl)propyl]thiazol-4-yl]benzonitrile
  • 4-[2-[(2r,3r)-3-(2,4-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]-1,3-thiazol-4-yl]benzonitrile
  • benzonitrile, 4-(2-((1r,2r)-2-(2,4-difluorophenyl)-2-hydroxy-1-methyl-3-(1h-1,2,4-triazol-1-yl)propyl)-4-thiazolyl)-
  • benzonitrile, 4-[2-[(1r,2r)-2-(2,4-difluro-phenyl)-2-hydroxy-1-methyl-3-(1h-1,2,4-triazol-1-yl)propyl]-4-thiazolyl]-
  • bms 207147
  • bms-207,147
  • bms-207147
  • d02556
  • er 30346
  • er-30346
  • rcz
  • rvc
  • rvz
CAS Number(s)
  • 182760-06-1
InChIKey OPAHEYNNJWPQPX-RCDICMHDSA-N
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