N-(2-Cyclopropylethyl)-6-{4-[5-Fluoro-2-(Trifluoromethyl)Benzoyl]-1-Piperazinyl}-3-Pyridazinecarboxamide

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Properties Simple | Detailed

Formula C22H23F4N5O2
IUPAC Name n-(2-cyclopropylethyl)-6-[4-[5-fluoro-2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridazine-3-carboxamide
Molecular Mass 465.444 g·mol−1
Heat of Formation -805.2 ± 16.7 kJ·mol−1
Dipole Moment 4.03 ± 1.08 D
Volume 517.74 Å 3
Surface Area 439.14 Å 2
HOMO Energy -9.14 ± 0.55 eV
LUMO Energy 1.65 ± eV
Point Group Symmetry C1
Synonyms
  • n-(2-cyclopropylethyl)-6-[4-[5-fluoro-2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridazine-3-carboxamide
  • n-(2-cyclopropylethyl)-6-[4-[5-fluoro-2-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]pyridazine-3-carboxamide
  • n-(2-cyclopropylethyl)-6-[4-[[5-fluoro-2-(trifluoromethyl)phenyl]-oxomethyl]-1-piperazinyl]-3-pyridazinecarboxamide
InChIKey QMZSSLLJQUFMHM-UHFFFAOYSA-N
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