Found 101 results

Search term: MF = 'C_{19}H_{16}FN_{5}O_{2}S_{2}'
ChemSpider 2D Image | 3-[({4-Allyl-5-[(2-fluorophenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-5-(2-thienyl)-1,2,4-oxadiazole | C19H16FN5O2S2

3-[({4-Allyl-5-[(2-fluorophenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-5-(2-thienyl)-1,2,4-oxadiazole

  • Molecular FormulaC19H16FN5O2S2
  • Average mass429.491 Da
  • Monoisotopic mass429.072937 Da
  • ChemSpider ID22381077

More details:

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

1,2,4-Oxadiazole, 3-[[[5-[(2-fluorophenoxy)methyl]-4-(2-propen-1-yl)-4H-1,2,4-triazol-3-yl]thio]methyl]-5-(2-thienyl)- [ACD/Index Name]
3-[({4-Allyl-5-[(2-fluorophenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-5-(2-thienyl)-1,2,4-oxadiazole [ACD/IUPAC Name]
3-[({4-Allyl-5-[(2-fluorophénoxy)méthyl]-4H-1,2,4-triazol-3-yl}sulfanyl)méthyl]-5-(2-thiényl)-1,2,4-oxadiazole [French] [ACD/IUPAC Name]
3-[({4-Allyl-5-[(2-fluorphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-5-(2-thienyl)-1,2,4-oxadiazol [German] [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: 647.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.5±3.0 kJ/mol
Flash Point: 345.4±34.3 °C
Index of Refraction: 1.692
Molar Refractivity: 114.2±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.63
ACD/LogD (pH 5.5): 3.49
ACD/BCF (pH 5.5): 266.65
ACD/KOC (pH 5.5): 1897.14
ACD/LogD (pH 7.4): 3.49
ACD/BCF (pH 7.4): 266.66
ACD/KOC (pH 7.4): 1897.16
Polar Surface Area: 132 Å2
Polarizability: 45.3±0.5 10-24cm3
Surface Tension: 55.2±7.0 dyne/cm
Molar Volume: 297.9±7.0 cm3

Click to predict properties on the Chemicalize site


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