O-(2-Methyl-2-Propanyl)-N-{[(2-Methyl-2-Propanyl)Oxy]Carbonyl}-L-Threonyl-N-{(2R)-5-Ethoxy-5-Oxo-1-[(3S)-2-Oxo-3-Pyrrolidinyl]-2-Pentanyl}-L-Phenylalaninamide

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Properties Simple | Detailed

Formula C33H52N4O8
IUPAC Name ethyl (4r)-4-[[(2s)-2-[[(2s,3r)-3-tert-butoxy-2-(tert-butoxycarbonylamino)butanoyl]amino]-3-phenyl-propanoyl]amino]-5-[(3s)-2-oxopyrrolidin-3-yl]pentanoate
Molecular Mass 632.788 g·mol−1
Heat of Formation -1745.4 ± 16.7 kJ·mol−1
Dipole Moment 4.18 ± 1.08 D
Volume 820.26 Å 3
Surface Area 606.91 Å 2
HOMO Energy -9.22 ± 0.55 eV
LUMO Energy 0.46 ± eV
Point Group Symmetry C1
InChIKey SNZMLKYHPQYHPN-DPURIWRLSA-N
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