4-Azido-N-(4-{[3-(2-Pyridinyldisulfanyl)Propanoyl]Amino}Butyl)Benzamide

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Properties Simple | Detailed

Formula C19H23N6O2S2
IUPAC Name 4-azido-n-[4-[3-(2-pyridyldisulfanyl)propanoylamino]butyl]benzamide
Molecular Mass 431.555 g·mol−1
Heat of Formation 121.7 ± 16.7 kJ·mol−1
Dipole Moment 6.17 ± 1.08 D
Volume 536.64 Å 3
Surface Area 391.13 Å 2
HOMO Energy -8.64 ± 0.55 eV
LUMO Energy -1.06 ± eV
Point Group Symmetry C1
Synonyms
  • 4-azido-n-[4-[3-(2-pyridyldisulfanyl)propanoylamino]butyl]benzamide
  • 4-azido-n-[4-[[1-oxo-3-(2-pyridyldisulfanyl)propyl]amino]butyl]benzamide
  • azbpdp
  • benzamide, 4-azido-n-(4-((1-oxo-3-(2-pyridinyldithio)propyl)amino)butyl)-
  • n-(4-(4-azidobenzamido)butyl)-3-(2'-pyridyldithio)propionamide
  • n-(4-(p-azidobenzamido)butyl)-3-(2'-pyridyldithio)propionamide
CAS Number(s)
  • 143706-33-6
InChIKey CECBRBWAUYIOQG-UHFFFAOYSA-N
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