5-{3,4-Difluoro-2-[(2-Fluoro-4-Iodophenyl)Amino]Phenyl}-N-[2-(4-Morpholinyl)Ethyl]-1,3,4-Oxadiazol-2-Amine

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Properties Simple | Detailed

Formula C20H19F3IN5O2
IUPAC Name 5-[3,4-difluoro-2-(2-fluoro-4-iodo-anilino)phenyl]-n-(2-morpholinoethyl)-1,3,4-oxadiazol-2-amine
Molecular Mass 545.297 g·mol−1
Heat of Formation -352.0 ± 16.7 kJ·mol−1
Dipole Moment 6.69 ± 1.08 D
Volume 501.02 Å 3
Surface Area 445.65 Å 2
HOMO Energy -8.60 ± 0.55 eV
LUMO Energy 1.87 ± eV
Point Group Symmetry C1
Synonyms
  • 5-[3,4-difluoro-2-[(2-fluoro-4-iodo-phenyl)amino]phenyl]-n-(2-morpholin-4-ylethyl)-1,3,4-oxadiazol-2-amine
  • 5-[3,4-difluoro-2-[(2-fluoro-4-iodo-phenyl)amino]phenyl]-n-(2-morpholinoethyl)-1,3,4-oxadiazol-2-amine
  • 5-[3,4-difluoro-2-[(2-fluoro-4-iodophenyl)amino]phenyl]-n-(2-morpholinoethyl)-1,3,4-oxadiazol-2-amine
  • 5-{3,4-difluoro-2-[(2-fluoro-4-iodophenyl)amino]phenyl}-n-(2-morpholin-4-ylethyl)-1,3,4-oxadiazol-2-amine
  • 5ea
  • [5-[3,4-difluoro-2-[(2-fluoro-4-iodo-phenyl)amino]phenyl]-1,3,4-oxadiazol-2-yl]-(2-morpholinoethyl)amine
InChIKey LZZYEMSEMRUPIM-UHFFFAOYSA-N
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