5-{[7-(Benzyloxy)-4-Quinazolinyl]Amino}-4-Fluoro-2-Methylphenol

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Properties Simple | Detailed

Formula C22H18FN3O2
IUPAC Name 5-[(7-benzyloxyquinazolin-4-yl)amino]-4-fluoro-2-methyl-phenol
Molecular Mass 375.396 g·mol−1
Heat of Formation -118.4 ± 16.7 kJ·mol−1
Dipole Moment 3.87 ± 1.08 D
Volume 426.95 Å 3
Surface Area 391.5 Å 2
HOMO Energy -8.69 ± 0.55 eV
LUMO Energy -0.99 ± eV
Point Group Symmetry C1
Synonyms
  • 4-fluoro-2-methyl-5-[[7-(phenylmethoxy)-4-quinazolinyl]amino]phenol
  • 4-fluoro-2-methyl-5-[[7-(phenylmethoxy)quinazolin-4-yl]amino]phenol
  • 5-[[7-(benzyloxy)quinazolin-4-yl]amino]-4-fluoro-2-methyl-phenol
InChIKey NVBNDZZLJRYRPD-UHFFFAOYSA-N
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