N-(4-(4-(1,2-Benzisothiazol-3-Yl)-1-Piperazinyl)Butyl)-1,1-Cyclopentanediacetimide

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Properties Simple | Detailed

Formula C24H32N4O2S
IUPAC Name 8-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-8-azaspiro[4.5]decane-7,9-dione
Molecular Mass 440.601 g·mol−1
Heat of Formation -220.0 ± 16.7 kJ·mol−1
Dipole Moment 6.50 ± 1.08 D
Volume 535.44 Å 3
Surface Area 461.48 Å 2
HOMO Energy -8.20 ± 0.55 eV
LUMO Energy 2.45 ± eV
Point Group Symmetry C1
Synonyms
  • 8-[4-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]butyl]-8-azaspiro[4.5]decane-7,9-dione
  • 8-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-8-azaspiro[4.5]decane-7,9-quinone
  • 8-azaspiro(4,5)decane-7,9-dione, 8-(4-(4-(1,2-benzisothiazol-3-yl)-1-piperazinyl)butyl)-
  • pdsp1_000473
  • pdsp1_000474
  • pdsp2_000471
  • pdsp2_000472
  • tiospirona [spanish]
  • tiospirone
  • tiospironum [latin]
InChIKey ZFZPJDFBJFHYIV-UHFFFAOYSA-N
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