Devazepide

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Properties Simple | Detailed

Formula C25H20N4O2
IUPAC Name n-[(3s)-1-methyl-2-oxo-5-phenyl-3h-1,4-benzodiazepin-3-yl]indol-1-ium-2-ylium-2-carboxamide
Molecular Mass 408.452 g·mol−1
Heat of Formation 172.3 ± 16.7 kJ·mol−1
Dipole Moment 4.63 ± 1.08 D
Volume 471.39 Å 3
Surface Area 413.42 Å 2
HOMO Energy -8.73 ± 0.55 eV
LUMO Energy -0.80 ± eV
Point Group Symmetry C1
Synonyms
  • d02693
  • devacade
  • devazepide (usan)
  • l-364718
  • mk-329
  • n-[(3s)-1-methyl-2-oxo-5-phenyl-3h-1,4-benzodiazepin-3-yl]-1h-indole-2-carboxamide
  • n-[(3s)-2-keto-1-methyl-5-phenyl-3h-1,4-benzodiazepin-3-yl]-1h-indole-2-carboxamide
  • pdsp1_000936
  • pdsp2_000922
CAS Number(s)
  • 103420-77-5
InChIKey NFHRQQKPEBFUJK-HSZRJFAPSA-N
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