4-Amino-8-Butyl-N-(Cyclopropylmethyl)-3-Cinnolinecarboxamide

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Properties Simple | Detailed

Formula C17H22N4O
IUPAC Name 4-amino-8-butyl-n-(cyclopropylmethyl)cinnoline-3-carboxamide
Molecular Mass 298.383 g·mol−1
Heat of Formation 49.2 ± 16.7 kJ·mol−1
Dipole Moment 3.29 ± 1.08 D
Volume 372.83 Å 3
Surface Area 344.26 Å 2
HOMO Energy -8.80 ± 0.55 eV
LUMO Energy -0.97 ± eV
Point Group Symmetry C1
Synonyms
  • 3-cinnolinecarboxamide, 4-amino-8-butyl-n-(cyclopropylmethyl)-
  • 4-amino-8-butyl-n-(cyclopropylmethyl)cinnoline-3-carboxamide
  • ici 198256
  • ici-198,256
CAS Number(s)
  • 107346-18-9
InChIKey YZZUVXGTPDAWHI-UHFFFAOYSA-N
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