1-{1-[(2-Amino-4-Pyridinyl)Methyl]-1H-Indol-4-Yl}-3-(5-Bromo-2-Methoxyphenyl)Urea

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Properties Simple | Detailed

Formula C22H20BrN5O2
IUPAC Name 1-[1-[(2-amino-4-pyridyl)methyl]indol-1-ium-4-yl]-3-(5-bromo-2-methoxy-phenyl)urea
Molecular Mass 466.331 g·mol−1
Heat of Formation 92.4 ± 16.7 kJ·mol−1
Dipole Moment 5.50 ± 1.08 D
Volume 484.02 Å 3
Surface Area 432.35 Å 2
HOMO Energy -8.25 ± 0.55 eV
LUMO Energy 2.62 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[1-[(2-amino-4-pyridyl)methyl]-4-indolyl]-3-(5-bromo-2-methoxyphenyl)urea
  • 1-[1-[(2-amino-4-pyridyl)methyl]indol-4-yl]-3-(5-bromo-2-methoxy-phenyl)urea
  • 1-[1-[(2-aminopyridin-4-yl)methyl]indol-4-yl]-3-(5-bromo-2-methoxy-phenyl)urea
  • 1-[1-[(2-aminopyridin-4-yl)methyl]indol-4-yl]-3-(5-bromo-2-methoxyphenyl)urea
InChIKey ZXBFYBLSJMEBEP-UHFFFAOYSA-N
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Elements H C O Br N