Methyl 2-(N-{[5-Amino-2-(4-Fluorophenyl)-6-Oxo-1(6H)-Pyrimidinyl]Acetyl}-L-Phenylalanyl)-1,3-Benzoxazole-5-Carboxylate

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Formula C30H24FN5O6+
IUPAC Name methyl 2-[(2s)-2-[[2-[5-amino-2-(4-fluorophenyl)-6-oxo-pyrimidin-1-yl]acetyl]amino]-3-phenyl-propanoyl]-1,3-benzoxazole-5-carboxylate
Molecular Mass 569.540 g·mol−1
Heat of Formation -622.0 ± 16.7 kJ·mol−1
Dipole Moment 2.27 ± 1.08 D
Volume 643.96 Å 3
Surface Area 512.24 Å 2
HOMO Energy -8.51 ± 0.55 eV
LUMO Energy 1.46 ± eV
Point Group Symmetry C1
InChIKey YGRSMPVCBHOYMS-QHCPKHFHSA-N
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