(2R)-1-[3-Carbamimidoyl-N-(2-Naphthylsulfonyl)-L-Phenylalanyl]-2-Piperidinecarboxylic Acid

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Formula C26H28N4O5S
IUPAC Name (2r)-1-[(2s)-3-(3-carbamimidoylphenyl)-2-(2-naphthylsulfonylamino)propanoyl]piperidine-2-carboxylic acid
Molecular Mass 508.589 g·mol−1
Heat of Formation -623.6 ± 16.7 kJ·mol−1
Dipole Moment 8.20 ± 1.08 D
Volume 576.1 Å 3
Surface Area 433.59 Å 2
HOMO Energy -9.00 ± 0.55 eV
LUMO Energy -1.41 ± eV
Point Group Symmetry C1
Synonyms
  • (2r)-1-[(2s)-3-(3-amidinophenyl)-2-(2-naphthylsulfonylamino)propanoyl]pipecolinic acid
  • (2r)-1-[(2s)-3-(3-carbamimidoylphenyl)-2-(2-naphthylsulfonylamino)-1-oxopropyl]-2-piperidinecarboxylic acid
  • (2r)-1-[(2s)-3-(3-carbamimidoylphenyl)-2-(2-naphthylsulfonylamino)propanoyl]piperidine-2-carboxylic acid
  • (2r)-1-[(2s)-3-(3-carbamimidoylphenyl)-2-(naphthalen-2-ylsulfonylamino)propanoyl]piperidine-2-carboxylic acid
  • fd1
  • n-alpha-(2-naphthylsulfonyl)-n-(3-amidino-l-phenylalaninyl)-d-pipecolinic acid
InChIKey GNANSBQAIRJZPA-XZOQPEGZSA-N
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