ChemSpider 2D Image | N-(2-Furylmethyl)-2-[(5-[2-(2-thienyl)ethyl]-4-{(E)-[4-(trifluoromethyl)benzylidene]amino}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide | C23H20F3N5O2S2

N-(2-Furylmethyl)-2-[(5-[2-(2-thienyl)ethyl]-4-{(E)-[4-(trifluoromethyl)benzylidene]amino}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide

  • Molecular FormulaC23H20F3N5O2S2
  • Average mass519.562 Da
  • Monoisotopic mass519.101074 Da
  • ChemSpider ID126479753

  • Double-bond stereo - Double-bond stereo

More details:

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

Acetamide, N-(2-furanylmethyl)-2-[[5-[2-(2-thienyl)ethyl]-4-[[(1E)-[4-(trifluoromethyl)phenyl]methylene]amino]-4H-1,2,4-triazol-3-yl]thio]- [ACD/Index Name]
N-(2-Furylmethyl)-2-[(5-[2-(2-thienyl)ethyl]-4-{(E)-[4-(trifluormethyl)benzyliden]amino}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamid [German] [ACD/IUPAC Name]
N-(2-Furylmethyl)-2-[(5-[2-(2-thienyl)ethyl]-4-{(E)-[4-(trifluoromethyl)benzylidene]amino}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide [ACD/IUPAC Name]
N-(2-Furylméthyl)-2-[(5-[2-(2-thiényl)éthyl]-4-{(E)-[4-(trifluorométhyl)benzylidène]amino}-4H-1,2,4-triazol-3-yl)sulfanyl]acétamide [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: 1.647
Molar Refractivity: 132.5±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 5.53
ACD/LogD (pH 5.5): 4.84
ACD/BCF (pH 5.5): 2781.15
ACD/KOC (pH 5.5): 10161.16
ACD/LogD (pH 7.4): 4.84
ACD/BCF (pH 7.4): 2781.77
ACD/KOC (pH 7.4): 10163.41
Polar Surface Area: 139 Å2
Polarizability: 52.5±0.5 10-24cm3
Surface Tension: 51.1±7.0 dyne/cm
Molar Volume: 364.8±7.0 cm3

Click to predict properties on the Chemicalize site


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