ChemSpider 2D Image | N'-{2-[(3-Fluorobenzyl)oxy]-5-nitrobenzylidene}-4-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}benzohydrazide | C25H21FN6O4S

N'-{2-[(3-Fluorobenzyl)oxy]-5-nitrobenzylidene}-4-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}benzohydrazide

  • Molecular FormulaC25H21FN6O4S
  • Average mass520.535 Da
  • Monoisotopic mass520.132874 Da
  • ChemSpider ID2811070

More details:

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

Benzoic acid, 4-[[(4-methyl-4H-1,2,4-triazol-3-yl)thio]methyl]-, 2-[[2-[(3-fluorophenyl)methoxy]-5-nitrophenyl]methylene]hydrazide [ACD/Index Name]
N'-{2-[(3-Fluorbenzyl)oxy]-5-nitrobenzyliden}-4-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}benzohydrazid [German] [ACD/IUPAC Name]
N'-{2-[(3-Fluorobenzyl)oxy]-5-nitrobenzylidene}-4-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}benzohydrazide [ACD/IUPAC Name]
N'-{2-[(3-Fluorobenzyl)oxy]-5-nitrobenzylidène}-4-{[(4-méthyl-4H-1,2,4-triazol-3-yl)sulfanyl]méthyl}benzohydrazide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.663
Molar Refractivity: 139.1±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 4.05
ACD/LogD (pH 5.5): 4.16
ACD/BCF (pH 5.5): 854.55
ACD/KOC (pH 5.5): 4366.25
ACD/LogD (pH 7.4): 4.16
ACD/BCF (pH 7.4): 854.68
ACD/KOC (pH 7.4): 4366.92
Polar Surface Area: 153 Å2
Polarizability: 55.2±0.5 10-24cm3
Surface Tension: 55.6±7.0 dyne/cm
Molar Volume: 375.7±7.0 cm3

Click to predict properties on the Chemicalize site


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