Lurasidone

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Properties Simple | Detailed

Formula C28H36N4O2S
IUPAC Name lurasidone
Molecular Mass 492.676 g·mol−1
Heat of Formation -169.3 ± 16.7 kJ·mol−1
Dipole Moment 5.23 ± 1.08 D
Volume 600.51 Å 3
Surface Area 480.83 Å 2
HOMO Energy -8.22 ± 0.55 eV
LUMO Energy 2.43 ± eV
Point Group Symmetry C1
Synonyms
  • (3ar,4s,7r,7as)-2-((1r,2r)-2-(4-(1,2-benzothiazol-3-yl)piperazin-1-ylmethyl)cyclohexylmethyl)hexahydro-4,7-methano-2h-isoindole-1,3-dione
  • pdsp2_001043
  • sm-13496
  • sm13496
CAS Number(s)
  • 367514-87-2
InChIKey PQXKDMSYBGKCJA-CVTJIBDQSA-N
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