7-Chloro-1-{2-[Ethyl(2-Hydroxyethyl)Amino]Ethyl}-5-(2-Fluorophenyl)-1,3-Dihydro-2H-1,4-Benzodiazepin-2-One

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Properties Simple | Detailed

Formula C21H23ClFN3O2
IUPAC Name 7-chloro-1-[2-[ethyl(2-hydroxyethyl)amino]ethyl]-5-(2-fluorophenyl)-3h-1,4-benzodiazepin-2-one
Molecular Mass 403.878 g·mol−1
Heat of Formation -320.2 ± 16.7 kJ·mol−1
Dipole Moment 4.09 ± 1.08 D
Volume 476.42 Å 3
Surface Area 364.5 Å 2
HOMO Energy -9.00 ± 0.55 eV
LUMO Energy 2.11 ± eV
Point Group Symmetry C1
Synonyms
  • 2h-1,4-benzodiazepin-2-one, 7-chloro-1-(2-(ethyl(2-hydroxyethyl)amino)ethyl)-5-(2-fluorophenyl)-1,3-dihydro-
  • 7-chloro-1-[2-(ethyl-(2-hydroxyethyl)amino)ethyl]-5-(2-fluorophenyl)-3h-1,4-benzodiazepin-2-one
  • hydroxyethylflurazepam
CAS Number(s)
  • 67263-28-9
InChIKey IRYBKIZHCXMFFO-UHFFFAOYSA-N
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Elements C F H Cl O N