N-[(2S)-4-(5-Fluoro-2-Pyrimidinyl)-1-({4-[5-(2,2,2-Trifluoroethoxy)-2-Pyrimidinyl]-1-Piperazinyl}Sulfonyl)-2-Butanyl]-N-Hydroxyformamide

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Properties Simple | Detailed

Formula C19H23F4N7O5S
IUPAC Name n-[(1s)-3-(5-fluoropyrimidin-2-yl)-1-[[4-[5-(2,2,2-trifluoroethoxy)pyrimidin-2-yl]piperazin-1-yl]sulfonylmethyl]propyl]-n-hydroxy-formamide
Molecular Mass 537.488 g·mol−1
Heat of Formation -1229.8 ± 16.7 kJ·mol−1
Dipole Moment 4.58 ± 1.08 D
Volume 562.83 Å 3
Surface Area 471.55 Å 2
HOMO Energy -8.83 ± 0.55 eV
LUMO Energy -1.36 ± eV
Point Group Symmetry C1
InChIKey BEMGDWJRAZUSRP-HNNXBMFYSA-N
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