4-{[5-(Cyclopropylcarbamoyl)-2-Methylphenyl]Amino}-5-Methyl-N-Propylpyrrolo[2,1-F][1,2,4]Triazine-6-Carboxamide

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Formula C22H26N6O2
IUPAC Name 4-[5-(cyclopropylcarbamoyl)-2-methyl-anilino]-5-methyl-n-propyl-pyrrolo[2,1-f][1,2,4]triazine-6-carboxamide
Molecular Mass 406.481 g·mol−1
Heat of Formation 41.4 ± 16.7 kJ·mol−1
Dipole Moment 2.56 ± 1.08 D
Volume 496.03 Å 3
Surface Area 437.58 Å 2
HOMO Energy -8.92 ± 0.55 eV
LUMO Energy -1.30 ± eV
Point Group Symmetry C1
Synonyms
  • 4-[[5-(cyclopropylcarbamoyl)-2-methyl-phenyl]amino]-5-methyl-n-propyl-pyrrolo[5,1-f][1,2,4]triazine-6-carboxamide
  • 4-[[5-[(cyclopropylamino)-oxomethyl]-2-methylphenyl]amino]-5-methyl-n-propyl-6-pyrrolo[5,1-f][1,2,4]triazinecarboxamide
InChIKey GDTQLZHHDRRBEB-UHFFFAOYSA-N
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