Sk&F 72517

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Properties Simple | Detailed

Formula C19H18ClFN2O3S
IUPAC Name 7-chloro-1-(2-ethylsulfonylethyl)-5-(2-fluorophenyl)-3h-1,4-benzodiazepin-2-one
Molecular Mass 408.874 g·mol−1
Heat of Formation -466.4 ± 16.7 kJ·mol−1
Dipole Moment 8.29 ± 1.08 D
Volume 443.28 Å 3
Surface Area 364.63 Å 2
HOMO Energy -9.22 ± 0.55 eV
LUMO Energy -1.19 ± eV
Point Group Symmetry C1
Synonyms
  • 2h-1,4-benzodiazepin-2-one, 7-chloro-1-(2-(ethylsulfonyl)ethyl)-5-(2-fluorophenyl)-1,3-dihydro-
  • 2h-1,4-benzodiazepin-2-one, 7-chloro-1-[2-(ethylsulfonyl)ethyl]-5-(2-fluorophenyl)-1,3-dihydro-
  • 7-chloro-1-(2-(ethylsulfonyl)ethyl)-5-(2-fluorophenyl)-1,3-dihydro-2h-1,4-benzodiazep in-2-one
  • 7-chloro-1-(2-(ethylsulfonyl)ethyl)-5-(o-fluorophenyl)-1,3-dihydro-2h-1,4-benzodiazepin-2-one
  • 7-chloro-1-[2-(ethylsulfonyl)ethyl]-5-(o-fluorophenyl)-1,3-dihydro-2h-1,4-benzodiazepin-2-one
  • d03973
  • elfazepam
  • elfazepam (usan)
CAS Number(s)
  • 52042-01-0
InChIKey BSPSXMXQKZZNFP-UHFFFAOYSA-N
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