Benzyl [(2S)-3-Methyl-1-Oxo-1-{[(2S)-1-Oxo-3-Phenyl-2-Propanyl]Amino}-2-Butanyl]Carbamate

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Properties Simple | Detailed

Formula C22H26N2O4
IUPAC Name benzyl n-[(1s)-1-[[(1s)-1-benzyl-2-oxo-ethyl]carbamoyl]-2-methyl-propyl]carbamate
Molecular Mass 382.453 g·mol−1
Heat of Formation -553.4 ± 16.7 kJ·mol−1
Dipole Moment 3.33 ± 1.08 D
Volume 486.15 Å 3
Surface Area 410.89 Å 2
HOMO Energy -9.54 ± 0.55 eV
LUMO Energy -0.12 ± eV
Point Group Symmetry C1
Synonyms
  • bcbcmap01_000248
  • bio2_000277
  • bio2_000757
  • carbamic acid, ((1s)-1-((((1s)-1-formyl-2-phenylethyl)amino)carbonyl)-2-methylpropyl)-, phenyl ester
  • carbamic acid, (1-(((1-formyl-2-phenylethyl)amino)carbonyl)-2-methylpropyl)-, phenylmethyl ester, (s-(r*,r*))-
  • carbobenzoxyvalylphenylalanine aldehyde
  • cbz-val-phe-cho
  • cbz-val-phe-h
  • cbz-valpheh
  • mdl 28170
  • mdl-28170
  • n-[(1s)-1-[[(1s)-1-(benzyl)-2-keto-ethyl]carbamoyl]-2-methyl-propyl]carbamic acid benzyl ester
  • n-[(1s)-1-[[[(1s)-1-formyl-2-phenylethyl]amino]-oxomethyl]-2-methylpropyl]carbamic acid phenylmethyl ester
  • n-[n-[(phenylmethoxy)carbonyl]-l-valyl]-l-phenylalanine, aldehyde deriv.
  • n-benzyloxycarbonylvalylphenylalaninal
  • n-benzyloxycarbonylvalylphenylalanine aldehyde
  • n-cbz-val-phe-al
  • phenylmethyl ((1s)-1-((((1s)-1-formyl-2-phenylethyl)amino)carbonyl)-2-methylpropyl)carbamate
  • phenylmethyl n-[(1s)-1-[[(1s)-1-formyl-2-phenyl-ethyl]carbamoyl]-2-methyl-propyl]carbamate
  • phenylmethyl n-[(2s)-3-methyl-1-oxo-1-[[(2s)-1-oxo-3-phenyl-propan-2-yl]amino]butan-2-yl]carbamate
  • phenylmethyl n-[(2s)-3-methyl-1-oxo-1-[[(2s)-1-oxo-3-phenylpropan-2-yl]amino]butan-2-yl]carbamate
CAS Number(s)
  • 88191-84-8
InChIKey NGBKFLTYGSREKK-PMACEKPBSA-N
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