Sorafenib

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Properties Simple | Detailed

Formula C21H17ClF3N4O3
IUPAC Name 4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]phenoxy]-n-methyl-3h-pyridin-1-ium-3-ide-2-carboxamide
Molecular Mass 465.833 g·mol−1
Heat of Formation -847.8 ± 16.7 kJ·mol−1
Dipole Moment 4.90 ± 1.08 D
Volume 477.56 Å 3
Surface Area 437.74 Å 2
HOMO Energy -9.08 ± 0.55 eV
LUMO Energy -1.05 ± eV
Point Group Symmetry C1
Synonyms
  • 2-pyridinecarboxamide, 4-(4-((((4-chloro-3-(trifluoromethyl)phenyl)amino)carbonyl)amino)phenoxy)-n-methyl-
  • 4-(4-((((4-chloro-3-(trifluoromethyl)phenyl)amino)carbonyl)amino)phenoxy)-n-methyl-2-pyridinecarboxamide
  • 4-(4-(3-(4-chloro-3-trifluoromethylphenyl)ureido)phenoxy)pyridine-2-carboxyllic acid methyamide-4-methylbenzenesulfonate
  • 4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]phenoxy]-n-methyl-picolinamide
  • 4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]phenoxy]-n-methyl-pyridine-2-carboxamide
  • 4-[4-[[[[4-chloro-3-(trifluoromethyl)phenyl]amino]-oxomethyl]amino]phenoxy]-n-methyl-2-pyridinecarboxamide
  • 4-{4-[({[4-chloro-3-(trifluoromethyl)phenyl]amino}carbonyl)amino]phenoxy}-n-methylpyridine-2-carboxamide
  • bax
  • bay 43-9006
  • bay-43-9006
  • bay-54-9085
  • k00597a
  • n-(4-chloro-3-(trifluoromethyl)phenyl)-n'-(4-(2-(n-methylcarbamoyl)-4-pyridyloxy)phenyl)urea
CAS Number(s)
  • 284461-73-0
InChIKey MLDQJTXFUGDVEO-UHFFFAOYSA-N
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