N-(3-Aminobenzyl)-6-(4-((3-Fluorobenzyl)Oxy)Phenoxy)Nicotinamide

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Properties Simple | Detailed

Formula C26H22FN3O3
IUPAC Name n-[(3-aminophenyl)methyl]-6-[4-[(3-fluorophenyl)methoxy]phenoxy]pyridine-3-carboxamide
Molecular Mass 443.470 g·mol−1
Heat of Formation -246.1 ± 16.7 kJ·mol−1
Dipole Moment 3.87 ± 1.08 D
Volume 514.51 Å 3
Surface Area 467.21 Å 2
HOMO Energy -8.49 ± 0.55 eV
LUMO Energy 2.36 ± eV
Point Group Symmetry C1
Synonyms
  • n-(3-aminobenzyl)-6-[4-(3-fluorobenzyl)oxyphenoxy]nicotinamide
  • n-[(3-aminophenyl)methyl]-6-[4-[(3-fluorophenyl)methoxy]phenoxy]-3-pyridinecarboxamide
  • n-[(3-aminophenyl)methyl]-6-[4-[(3-fluorophenyl)methoxy]phenoxy]pyridine-3-carboxamide
InChIKey JZMLHJRKSJXARY-UHFFFAOYSA-N
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