(2S)-N-(4-Carbamimidoylbenzyl)-1-[(2R)-2-Cyclohexyl-2-{[2-(Ethylamino)-2-Oxoethyl]Amino}Acetyl]-2-Azetidinecarboxamide

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Formula C24H36N6O3
IUPAC Name (2s)-n-[(4-carbamimidoylphenyl)methyl]-1-[(2r)-2-cyclohexyl-2-[[2-(ethylamino)-2-oxo-ethyl]amino]acetyl]azetidine-2-carboxamide
Molecular Mass 456.581 g·mol−1
Heat of Formation -430.1 ± 16.7 kJ·mol−1
Dipole Moment 6.89 ± 1.08 D
Volume 570.49 Å 3
Surface Area 482.22 Å 2
HOMO Energy -9.32 ± 0.55 eV
LUMO Energy 0.01 ± eV
Point Group Symmetry C1
InChIKey HLAUGXKHYADQDF-PZJWPPBQSA-N
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