5-Oxo-L-Prolyl-N-({(2S)-1-[2-(4-Hydroxyphenyl)Ethyl]-2-Pyrrolidinyl}Carbonyl)-3-(4H-Imidazol-4-Yl)-L-Alaninamide

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Properties Simple | Detailed

Formula C24H30N6O5
IUPAC Name (2s)-n-[(1s)-2-[[(1s,2s)-1-[2-(4-hydroxyphenyl)ethyl]pyrrolidine-2-carbonyl]amino]-1-[[(4s)-4h-imidazol-4-yl]methyl]-2-oxo-ethyl]-5-oxo-pyrrolidine-2-carboxamide
Molecular Mass 482.532 g·mol−1
Heat of Formation -599.1 ± 16.7 kJ·mol−1
Dipole Moment 5.60 ± 1.08 D
Volume 596.5 Å 3
Surface Area 473.96 Å 2
HOMO Energy -9.13 ± 0.55 eV
LUMO Energy -1.01 ± eV
Point Group Symmetry C1
InChIKey MYHAKKNGRRKYTF-LEAZDLGRSA-N
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