2-Chloro-6-(4-{[(3,4-Dichloro-5-Methyl-1H-Pyrrol-2-Yl)Carbonyl]Amino}-1-Piperidinyl)Isonicotinamide

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Properties Simple | Detailed

Formula C17H18Cl3N5O2
IUPAC Name 2-chloro-6-[4-[(3,4-dichloro-5-methyl-pyrrol-1-ium-4-ide-2-carbonyl)amino]-1-piperidyl]pyridine-4-carboxamide
Molecular Mass 430.716 g·mol−1
Heat of Formation -276.5 ± 16.7 kJ·mol−1
Dipole Moment 2.77 ± 1.08 D
Volume 457.99 Å 3
Surface Area 404.55 Å 2
HOMO Energy -9.12 ± 0.55 eV
LUMO Energy -1.08 ± eV
Point Group Symmetry C1
Synonyms
  • 2-chloro-6-[4-[(3,4-dichloro-5-methyl-1h-pyrrol-2-yl)carbonylamino]piperidin-1-yl]pyridine-4-carboxamide
  • 2-chloro-6-[4-[(3,4-dichloro-5-methyl-1h-pyrrole-2-carbonyl)amino]-1-piperidyl]isonicotinamide
  • 2-chloro-6-[4-[(3,4-dichloro-5-methyl-1h-pyrrole-2-carbonyl)amino]-1-piperidyl]pyridine-4-carboxamide
  • 2-chloro-6-[4-[(3,4-dichloro-5-methyl1h-pyrrole-2-carbonyl)amino]piperidin-1-yl]pyridine-4-carboxamide
  • 2-chloro-6-[4-[[(3,4-dichloro-5-methyl-1h-pyrrol-2-yl)-oxomethyl]amino]-1-piperidinyl]-4-pyridinecarboxamide
InChIKey DDZQOAWVENUEIU-UHFFFAOYSA-N
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