Toceranib

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Properties Simple | Detailed

Formula C22H25FN4O2
IUPAC Name 5-[(z)-(5-fluoro-2-oxo-indolin-3-ylidene)methyl]-2,4-dimethyl-n-(2-pyrrolidin-1-ylethyl)pyrrol-1-ium-5-ylium-3-carboxamide
Molecular Mass 396.458 g·mol−1
Heat of Formation -312.0 ± 16.7 kJ·mol−1
Dipole Moment 5.09 ± 1.08 D
Volume 474.21 Å 3
Surface Area 418.78 Å 2
HOMO Energy -8.65 ± 0.55 eV
LUMO Energy -1.30 ± eV
Point Group Symmetry C1
Synonyms
  • 5-[(z)-(5-fluoro-2-keto-indolin-3-ylidene)methyl]-2,4-dimethyl-n-(2-pyrrolidin-1-ylethyl)-1h-pyrrole-3-carboxamide
  • 5-[(z)-(5-fluoro-2-oxo-1h-indol-3-ylidene)methyl]-2,4-dimethyl-n-(2-pyrrolidin-1-ylethyl)-1h-pyrrole-3-carboxamide
  • 5-[(z)-(5-fluoro-2-oxo-3-indolinylidene)methyl]-2,4-dimethyl-n-(2-1-pyrrolidinylethyl)-1h-pyrrole-3-carboxamide
  • 5-[(z)-(5-fluoro-2-oxo-indolin-3-ylidene)methyl]-2,4-dimethyl-n-(2-pyrrolidin-1-ylethyl)-1h-pyrrole-3-carboxamide
  • su11248 analog 12f
InChIKey SRSGVKWWVXWSJT-ATVHPVEESA-N
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