ChemSpider 2D Image | 1-Ethyl-3-{5'-(5-oxo-4,5-dihydro-1,3,4-oxadiazol-2-yl)-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]-3,3'-bipyridin-6-yl}urea | C19H14F3N7O3S

1-Ethyl-3-{5'-(5-oxo-4,5-dihydro-1,3,4-oxadiazol-2-yl)-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]-3,3'-bipyridin-6-yl}urea

  • Molecular FormulaC19H14F3N7O3S
  • Average mass477.420 Da
  • Monoisotopic mass477.083099 Da
  • ChemSpider ID34239855

More details:






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

1-Ethyl-3-{5'-(5-oxo-4,5-dihydro-1,3,4-oxadiazol-2-yl)-4-[4-(trifluormethyl)-1,3-thiazol-2-yl]-3,3'-bipyridin-6-yl}harnstoff [German] [ACD/IUPAC Name]
1-Ethyl-3-{5'-(5-oxo-4,5-dihydro-1,3,4-oxadiazol-2-yl)-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]-3,3'-bipyridin-6-yl}urea [ACD/IUPAC Name]
1-Éthyl-3-{5'-(5-oxo-4,5-dihydro-1,3,4-oxadiazol-2-yl)-4-[4-(trifluorométhyl)-1,3-thiazol-2-yl]-3,3'-bipyridin-6-yl}urée [French] [ACD/IUPAC Name]
Urea, N-[5'-(4,5-dihydro-5-oxo-1,3,4-oxadiazol-2-yl)-4-[4-(trifluoromethyl)-2-thiazolyl][3,3'-bipyridin]-6-yl]-N'-ethyl- [ACD/Index Name]
1YP

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.714
Molar Refractivity: 112.2±0.5 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 1.41
ACD/LogD (pH 5.5): 0.96
ACD/BCF (pH 5.5): 2.48
ACD/KOC (pH 5.5): 49.86
ACD/LogD (pH 7.4): -0.36
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.35
Polar Surface Area: 159 Å2
Polarizability: 44.5±0.5 10-24cm3
Surface Tension: 59.9±7.0 dyne/cm
Molar Volume: 285.8±7.0 cm3

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