3-(5-Cyclopropyl-1,2,4-Oxadiazol-3-Yl)-5-Methyl-4,5-Dihydro-6H-Imidazo[1,5-A][1,4]Benzodiazepin-6-One

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Formula C17H15N5O2
IUPAC Name 3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-5-methyl-4h-imidazo[1,5-a][1,4]benzodiazepin-6-one
Molecular Mass 321.333 g·mol−1
Heat of Formation 310.9 ± 16.7 kJ·mol−1
Dipole Moment 4.35 ± 1.08 D
Volume 366.3 Å 3
Surface Area 323.21 Å 2
HOMO Energy -9.34 ± 0.55 eV
LUMO Energy 1.99 ± eV
Point Group Symmetry C1
Synonyms
  • 3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-5,6-dihydro-5-methyl-6-oxo-4h-imidazo(1,5a)(1,4)benzodiazepine
  • 6h-imidazo(1,5-a)(1,4)benzodiazepin-6-one, 3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-4,5-dihydro-5-methyl-
  • comeib
  • fg 8119
  • fg-8119
CAS Number(s)
  • 106447-61-4
InChIKey YZIWCURGXWGKPE-UHFFFAOYSA-N
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