ChemSpider 2D Image | 1-(4-Fluorophenyl)-2-{[5-(4-fluorophenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl}ethanol | C20H14F2N2OS2

1-(4-Fluorophenyl)-2-{[5-(4-fluorophenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl}ethanol

  • Molecular FormulaC20H14F2N2OS2
  • Average mass400.465 Da
  • Monoisotopic mass400.051544 Da
  • ChemSpider ID30043153

More details:

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

1-(4-Fluorophenyl)-2-{[5-(4-fluorophenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl}ethanol [ACD/IUPAC Name]
1-(4-Fluorophényl)-2-{[5-(4-fluorophényl)thiéno[2,3-d]pyrimidin-4-yl]sulfanyl}éthanol [French] [ACD/IUPAC Name]
1-(4-Fluorphenyl)-2-{[5-(4-fluorphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl}ethanol [German] [ACD/IUPAC Name]
Benzenemethanol, 4-fluoro-α-[[[5-(4-fluorophenyl)thieno[2,3-d]pyrimidin-4-yl]thio]methyl]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 593.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.0±3.0 kJ/mol
Flash Point: 312.5±30.1 °C
Index of Refraction: 1.710
Molar Refractivity: 106.5±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.13
ACD/LogD (pH 5.5): 4.49
ACD/BCF (pH 5.5): 1519.40
ACD/KOC (pH 5.5): 6592.28
ACD/LogD (pH 7.4): 4.49
ACD/BCF (pH 7.4): 1519.42
ACD/KOC (pH 7.4): 6592.39
Polar Surface Area: 100 Å2
Polarizability: 42.2±0.5 10-24cm3
Surface Tension: 71.5±5.0 dyne/cm
Molar Volume: 272.6±5.0 cm3

Click to predict properties on the Chemicalize site


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