Temanogrel

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Formula C24H28N4O4
IUPAC Name 3-methoxy-n-[3-(2-methyl-4h-pyrazol-2-ium-4-id-3-yl)-4-(2-morpholinoethoxy)phenyl]benzamide
Molecular Mass 436.504 g·mol−1
Heat of Formation -254.6 ± 16.7 kJ·mol−1
Dipole Moment 4.48 ± 1.08 D
Volume 524.68 Å 3
Surface Area 453.42 Å 2
HOMO Energy -8.56 ± 0.55 eV
LUMO Energy 2.47 ± eV
Point Group Symmetry C1
Synonyms
  • 3-methoxy-n-[3-(2-methyl-3-pyrazolyl)-4-(2-morpholinoethoxy)phenyl]benzamide
  • 3-methoxy-n-[3-(2-methylpyrazol-3-yl)-4-(2-morpholin-4-ylethoxy)phenyl]benzamide
  • 3-methoxy-n-[3-(2-methylpyrazol-3-yl)-4-(2-morpholinoethoxy)phenyl]benzamide
InChIKey ZEOQUKRCASTCFR-UHFFFAOYSA-N
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