(3R,4R)-1-[3-Amino-6-(3,4,5-Trimethoxyphenyl)-2-Pyrazinyl]-3-Ethyl-4-Piperidinecarboxylic Acid

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Formula C21H28N4O5
IUPAC Name (1r,3r,4r)-1-[3-amino-6-(3,4,5-trimethoxyphenyl)pyrazin-2-yl]-3-ethyl-piperidine-4-carboxylic acid
Molecular Mass 416.471 g·mol−1
Heat of Formation -635.3 ± 16.7 kJ·mol−1
Dipole Moment 3.41 ± 1.08 D
Volume 494.53 Å 3
Surface Area 423.56 Å 2
HOMO Energy -8.46 ± 0.55 eV
LUMO Energy 2.38 ± eV
Point Group Symmetry C1
InChIKey MQOJTCBESRAKQA-GXTWGEPZSA-N
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