Volasertib

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Properties Simple | Detailed

Formula C26H22N8O3
IUPAC Name 2-(2-cyanoethynyl)-n-[4-[2-(cyclopropylmethylamino)ethynyl-ethynyl-amino]phenyl]-4-hydroxy-but-3-ynamide; n-(isocyanatomethyl)-n-methyl-ethynamine; molecular nitrogen
Molecular Mass 494.505 g·mol−1
Heat of Formation -257.1 ± 16.7 kJ·mol−1
Dipole Moment 2.84 ± 1.08 D
Volume 776.52 Å 3
Surface Area 651.19 Å 2
HOMO Energy -8.06 ± 0.55 eV
LUMO Energy -0.92 ± eV
Point Group Symmetry C1
InChIKey SXNJFOWDRLKDSF-STROYTFGSA-N
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