N~2~-Acetyl-N~1~-{[(2-Phenylethyl)Amino]Acetyl}-L-Aspartamide

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Properties Simple | Detailed

Formula C16H22N4O4
IUPAC Name (2s)-2-acetamido-n-[2-(2-phenylethylamino)acetyl]butanediamide
Molecular Mass 334.370 g·mol−1
Heat of Formation -652.1 ± 16.7 kJ·mol−1
Dipole Moment 4.03 ± 1.08 D
Volume 407.41 Å 3
Surface Area 379.85 Å 2
HOMO Energy -9.41 ± 0.55 eV
LUMO Energy 0.15 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-acetamido-n-[1-oxo-2-(2-phenylethylamino)ethyl]butanediamide
  • (2s)-2-acetamido-n-[2-(2-phenylethylamino)acetyl]butanediamide
  • (2s)-2-acetamido-n-[2-(2-phenylethylamino)acetyl]succinamide
  • (2s)-2-acetamido-n-[2-(2-phenylethylamino)ethanoyl]butanediamide
  • aagpa
  • n-acetylasparaginylglycyl-(n-phenethyl)amide
CAS Number(s)
  • 146429-43-8
InChIKey LMDNARFYJDOGJO-ZDUSSCGKSA-N
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