Darusentan

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Formula C22H22N2O6
IUPAC Name (2s)-2-(4,6-dimethoxypyrimidin-2-yl)oxy-3-methoxy-3,3-diphenyl-propanoic acid
Molecular Mass 410.420 g·mol−1
Heat of Formation -677.3 ± 16.7 kJ·mol−1
Dipole Moment 2.98 ± 1.08 D
Volume 475.82 Å 3
Surface Area 391.13 Å 2
HOMO Energy -9.40 ± 0.55 eV
LUMO Energy -0.19 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-(4,6-dimethoxypyrimidin-2-yl)oxy-3-methoxy-3,3-di(phenyl)propanoic acid
  • (2s)-2-(4,6-dimethoxypyrimidin-2-yl)oxy-3-methoxy-3,3-di(phenyl)propionic acid
  • (2s)-2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-3-methoxy-3,3-di(phenyl)propanoic acid
  • benzenepropanoic acid, alpha-((4,6-dimethoxy-2-pyrimidinyl)oxy)-beta-methoxy-beta-phenyl-, (alphas)-
  • benzenepropanoic acid, alpha-((4,6-dimethoxy-2-pyrimidinyl)oxy)-beta-methoxy-beta-phenyl-, (s)-
  • hmr-4005
  • lu 135252
  • lu-135252
  • lu135252
CAS Number(s)
  • 171714-84-4
  • 177036-80-5
InChIKey FEJVSJIALLTFRP-LJQANCHMSA-N
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