{5-[4-{[(1-Methyl-1,4-Dihydro-3-Pyridinyl)Carbonyl]Amino}-2-Oxo-1(2H)-Pyrimidinyl]Tetrahydro-2-Furanyl}Methyl 1-Methyl-1,4-Dihydro-3-Pyridinecarboxylate

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Properties Simple | Detailed

Formula C23H27N5O5
IUPAC Name [(2r,5s)-5-[4-[(1-methyl-4h-pyridine-3-carbonyl)amino]-2-oxo-pyrimidin-3-ium-1-yl]tetrahydrofuran-2-yl]methyl 1-methyl-4h-pyridine-3-carboxylate
Molecular Mass 453.491 g·mol−1
Heat of Formation -532.8 ± 16.7 kJ·mol−1
Dipole Moment 8.27 ± 1.08 D
Volume 526.66 Å 3
Surface Area 455.01 Å 2
HOMO Energy -8.24 ± 0.55 eV
LUMO Energy 2.76 ± eV
Point Group Symmetry C1
InChIKey MICHLJWXTWDTGH-UYAOXDASSA-N
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