N-(4-{[(2S)-1-Hydroxy-3-Phenyl-2-Propanyl]Amino}-4-Oxobutyl)-N-Methyl-L-Tyrosinamide

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Formula C23H31N3O4
IUPAC Name 4-[[(2r)-2-amino-3-(4-hydroxyphenyl)propanoyl]-methyl-amino]-n-[(1s)-1-benzyl-2-hydroxy-ethyl]butanamide
Molecular Mass 413.510 g·mol−1
Heat of Formation -704.0 ± 16.7 kJ·mol−1
Dipole Moment 4.23 ± 1.08 D
Volume 523.26 Å 3
Surface Area 368.53 Å 2
HOMO Energy -9.42 ± 0.55 eV
LUMO Energy 2.66 ± eV
Point Group Symmetry C1
InChIKey NYWBUISAOGPARC-PZJWPPBQSA-N
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