N-{(1R)-1-[3-(4-Ethoxyphenyl)-4-Oxo-3,4-Dihydropyrido[2,3-D]Pyrimidin-2-Yl]Ethyl}-2-[4-Fluoro-3-(Trifluoromethyl)Phenyl]-N-(3-Pyridinylmethyl)Acetamide

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Properties Simple | Detailed

Formula C32H27F4N5O3
IUPAC Name n-[(1r)-1-[3-(4-ethoxyphenyl)-4-oxopyrido[2,3-d]pyrimidin-2-yl]ethyl]-2-[4-fluoro-3-(trifluoromethyl)phenyl]-n-(pyridin-3-ylmethyl)acetamide
Molecular Mass 605.582 g·mol−1
Heat of Formation -876.1 ± 16.7 kJ·mol−1
Dipole Moment 5.27 ± 1.08 D
Volume 674.66 Å 3
Surface Area 522.4 Å 2
HOMO Energy -9.18 ± 0.55 eV
LUMO Energy 1.82 ± eV
Point Group Symmetry C1
InChIKey XMRGQUDUVGRCBS-HXUWFJFHSA-N
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