ChemSpider 2D Image | (5Z)-5-[({2-[({(1Z)-5-Fluoro-2-methyl-1-[4-(methylsulfanyl)benzylidene]-1H-inden-3-yl}acetyl)amino]ethoxy}carbonyl)imino]-3-phenyl-5H-1,2,3-oxadiazol-3-ium-2-ide | C31H27FN4O4S

(5Z)-5-[({2-[({(1Z)-5-Fluoro-2-methyl-1-[4-(methylsulfanyl)benzylidene]-1H-inden-3-yl}acetyl)amino]ethoxy}carbonyl)imino]-3-phenyl-5H-1,2,3-oxadiazol-3-ium-2-ide

  • Molecular FormulaC31H27FN4O4S
  • Average mass570.634 Da
  • Monoisotopic mass570.173706 Da
  • ChemSpider ID31124394

  • Double-bond stereo - Double-bond stereo

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(5Z)-5-[({2-[({(1Z)-5-Fluor-2-methyl-1-[4-(methylsulfanyl)benzyliden]-1H-inden-3-yl}acetyl)amino]ethoxy}carbonyl)imino]-3-phenyl-5H-1,2,3-oxadiazol-3-ium-2-id [German] [ACD/IUPAC Name]
(5Z)-5-[({2-[({(1Z)-5-Fluoro-2-methyl-1-[4-(methylsulfanyl)benzylidene]-1H-inden-3-yl}acetyl)amino]ethoxy}carbonyl)imino]-3-phenyl-5H-1,2,3-oxadiazol-3-ium-2-ide [ACD/IUPAC Name]
(5Z)-5-[({2-[(2-{(1Z)-5-Fluoro-2-méthyl-1-[4-(méthylsulfanyl)benzylidène]-1H-indén-3-yl}acétyl)amino]éthoxy}carbonyl)imino]-3-phényl-5H-1,2,3-oxadiazol-3-ium-2-ide [French] [ACD/IUPAC Name]
1,2,3-Oxadiazolium, 5-[[[2-[[2-[(1Z)-5-fluoro-2-methyl-1-[[4-(methylthio)phenyl]methylene]-1H-inden-3-yl]acetyl]amino]ethoxy]carbonyl]imino]-2,5-dihydro-3-phenyl-, inner salt, (5Z)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density:
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Index of Refraction:
Molar Refractivity:
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 105 Å2
Polarizability:
Surface Tension:
Molar Volume:

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