1-Methyl-2-Oxo-4-[4-(2-Thienylcarbonyl)-1-Piperazinyl]-1,2-Dihydro-3-Quinolinecarbonitrile

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Properties Simple | Detailed

Formula C20H19N4O2S+
IUPAC Name 1-methyl-2-oxo-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]-1h-quinolin-1-ium-3-carbonitrile
Molecular Mass 379.455 g·mol−1
Heat of Formation 105.9 ± 16.7 kJ·mol−1
Dipole Moment 10.40 ± 1.08 D
Volume 433.27 Å 3
Surface Area 362.08 Å 2
HOMO Energy -9.03 ± 0.55 eV
LUMO Energy 1.73 ± eV
Point Group Symmetry C1
Synonyms
  • 1-methyl-2-oxo-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)quinoline-3-carbonitrile
  • 1-methyl-2-oxo-4-[4-[oxo-(2-thienyl)methyl]-1-piperazinyl]-3-quinolinecarbonitrile
  • 2-keto-1-methyl-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]quinoline-3-carbonitrile
InChIKey GGGJOEPOPVIHEK-UHFFFAOYSA-N
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