(2S)-2-Acetamido-N-[(2S)-2-{[(2S)-4-Chloro-3-Oxo-2-Butanyl]Amino}Propanoyl]Propanamide

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Properties Simple | Detailed

Formula C12H20ClN3O4
IUPAC Name (2s)-n-[(2s)-2-acetamidopropanoyl]-2-[[(1s)-3-chloro-1-methyl-2-oxo-propyl]amino]propanamide
Molecular Mass 305.758 g·mol−1
Heat of Formation -805.8 ± 16.7 kJ·mol−1
Dipole Moment 2.31 ± 1.08 D
Volume 371.72 Å 3
Surface Area 336.38 Å 2
HOMO Energy -9.50 ± 0.55 eV
LUMO Energy 0.02 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-n-[(2s)-2-acetamido-1-oxopropyl]-2-[[(1s)-3-chloro-1-methyl-2-oxopropyl]amino]propanamide
  • (2s)-n-[(2s)-2-acetamidopropanoyl]-2-[[(1s)-3-chloro-1-methyl-2-oxo-propyl]amino]propanamide
  • (2s)-n-[(2s)-2-acetamidopropanoyl]-2-[[(1s)-3-chloro-2-keto-1-methyl-propyl]amino]propionamide
  • (2s)-n-[(2s)-2-acetamidopropanoyl]-2-[[(2s)-4-chloro-3-oxo-butan-2-yl]amino]propanamide
  • l-alaninamide, n-acetyl-l-alanyl-n-(3-chloro-1-methyl-2-oxopropyl)-, (s)-
  • n-acetyl-ala-ala-ala-chloromethyl ketone
  • n-acetylalanyl-alanyl-alanine chloromethyl ketone
CAS Number(s)
  • 38320-48-8
InChIKey GNIQQXMPBMHDNV-FXQIFTODSA-N
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