Alnespirone

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Properties Simple | Detailed

Formula C26H38N2O4
IUPAC Name 8-[4-[[(3s)-5-methoxychroman-3-yl]-propyl-amino]butyl]-8-azaspiro[4.5]decane-7,9-dione
Molecular Mass 442.591 g·mol−1
Heat of Formation -786.5 ± 16.7 kJ·mol−1
Dipole Moment 2.54 ± 1.08 D
Volume 568.19 Å 3
Surface Area 419.97 Å 2
HOMO Energy -8.70 ± 0.55 eV
LUMO Energy 3.10 ± eV
Point Group Symmetry C1
Synonyms
  • ( )-(s)-n-(4-((5-methoxy-3-chromanyl)propylamino)butyl)-1,1-cyclopentanediacetimide
  • 8-[4-[[(3s)-5-methoxy-3-chromanyl]-propylamino]butyl]-8-azaspiro[4.5]decane-7,9-dione
  • 8-[4-[[(3s)-5-methoxychroman-3-yl]-propyl-amino]butyl]-8-azaspiro[4.5]decane-7,9-dione
  • 8-[4-[[(3s)-5-methoxychroman-3-yl]-propyl-amino]butyl]-8-azaspiro[4.5]decane-7,9-quinone
  • 8-[4-[[(3s)-5-methoxychroman-3-yl]-propylamino]butyl]-8-azaspiro[4.5]decane-7,9-dione
CAS Number(s)
  • 138298-79-0
InChIKey DLLULNTXJPATBC-FQEVSTJZSA-N
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