1-{N-[(4-Methylphenyl)Sulfonyl]Glycyl-4-Carbamimidoyl-L-Phenylalanyl}Piperidine

Molecule SVG Image

Properties Simple | Detailed

Formula C24H31N5O4S
IUPAC Name n-[(2s)-3-(4-carbamimidoylphenyl)-1-oxo-1-piperidin-1-ylpropan-2-yl]-2-[(4-methylphenyl)sulfonylamino]acetamide
Molecular Mass 485.599 g·mol−1
Heat of Formation -548.5 ± 16.7 kJ·mol−1
Dipole Moment 12.51 ± 1.08 D
Volume 586.74 Å 3
Surface Area 424.69 Å 2
HOMO Energy -9.39 ± 0.55 eV
LUMO Energy -0.78 ± eV
Point Group Symmetry C1
Synonyms
  • n(alpha)-tosylglycyl-4-amidinophenylalanine piperidide
  • n-[(1s)-1-(4-amidinobenzyl)-2-keto-2-piperidino-ethyl]-2-[(4-methylphenyl)sulfonylamino]acetamide
  • n-[(1s)-1-[(4-carbamimidoylphenyl)methyl]-2-oxo-2-(1-piperidyl)ethyl]-2-[(4-methylphenyl)sulfonylamino]acetamide
  • n-[(2s)-3-(4-carbamimidoylphenyl)-1-oxo-1-piperidin-1-yl-propan-2-yl]-2-[(4-methylphenyl)sulfonylamino]ethanamide
  • nalpha-tosylglycyl-4-amidinophenylalanine piperidide
  • t-gly-a-phe-pip
CAS Number(s)
  • 99452-52-5
InChIKey VFOMWUXIXMBJJL-NRFANRHFSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H S C O N