N-{2-Methoxy-5-(2-Methyl-2-Propanyl)-3-[({4-[6-(4-Morpholinylmethyl)-3-Pyridinyl]-1-Naphthyl}Carbamoyl)Amino]Phenyl}Methanesulfonamide

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Properties Simple | Detailed

Formula C33H39N5O5S
IUPAC Name 1-[5-tert-butyl-3-(methanesulfonamido)-2-methoxy-phenyl]-3-[4-[6-(morpholinomethyl)-3-pyridyl]-1-naphthyl]urea
Molecular Mass 617.758 g·mol−1
Heat of Formation -537.5 ± 16.7 kJ·mol−1
Dipole Moment 5.51 ± 1.08 D
Volume 725.52 Å 3
Surface Area 607.38 Å 2
HOMO Energy -8.53 ± 0.55 eV
LUMO Energy -1.09 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(5-tert-butyl-3-methanesulfonamido-2-methoxy-phenyl)-3-[4-[6-(morpholinomethyl)-3-pyridyl]-1-naphthyl]urea
  • 1-(5-tert-butyl-3-methanesulfonamido-2-methoxyphenyl)-3-[4-[6-(morpholin-4-ylmethyl)pyridin-3-yl]naphthalen-1-yl]urea
  • 1-(5-tert-butyl-3-methanesulfonamido-2-methoxyphenyl)-3-[4-[6-(morpholinomethyl)-3-pyridyl]-1-naphthyl]urea
  • 1-[5-tert-butyl-2-methoxy-3-(methylsulfonylamino)phenyl]-3-[4-[6-(morpholin-4-ylmethyl)pyridin-3-yl]naphthalen-1-yl]urea
InChIKey KLPFPTSVYVEKOL-UHFFFAOYSA-N
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