{4-[4-(4-Carbamimidoylphenyl)-1-Piperazinyl]-1-Piperidinyl}Acetic Acid

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Properties Simple | Detailed

Formula C18H27N5O2
IUPAC Name 2-[4-[4-(4-carbamimidoylphenyl)piperazin-1-yl]-1-piperidyl]acetic acid
Molecular Mass 345.439 g·mol−1
Heat of Formation -145.2 ± 16.7 kJ·mol−1
Dipole Moment 1.93 ± 1.08 D
Volume 426.12 Å 3
Surface Area 377.61 Å 2
HOMO Energy -8.39 ± 0.55 eV
LUMO Energy 0.03 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[4-[4-(4-amidinophenyl)piperazin-1-yl]-1-piperidyl]acetic acid
  • 2-[4-[4-(4-carbamimidoylphenyl)-1-piperazinyl]-1-piperidinyl]acetic acid
  • 2-[4-[4-(4-carbamimidoylphenyl)piperazin-1-yl]piperidin-1-yl]acetic acid
  • 2-[4-[4-(4-carbamimidoylphenyl)piperazin-1-yl]piperidin-1-yl]ethanoic acid
InChIKey QGEGSJUSWLLZLH-UHFFFAOYSA-N
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