ChemSpider 2D Image | N-(4-Fluorophenyl)-7-[4-(trifluoromethyl)phenyl]-4,7-dihydrothieno[2,3-c]pyridine-6(5H)-carboxamide | C21H16F4N2OS

N-(4-Fluorophenyl)-7-[4-(trifluoromethyl)phenyl]-4,7-dihydrothieno[2,3-c]pyridine-6(5H)-carboxamide

  • Molecular FormulaC21H16F4N2OS
  • Average mass420.423 Da
  • Monoisotopic mass420.091949 Da
  • ChemSpider ID28506923

More details:

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

N-(4-Fluorophenyl)-7-[4-(trifluoromethyl)phenyl]-4,7-dihydrothieno[2,3-c]pyridine-6(5H)-carboxamide [ACD/IUPAC Name]
N-(4-Fluorophényl)-7-[4-(trifluorométhyl)phényl]-4,7-dihydrothiéno[2,3-c]pyridine-6(5H)-carboxamide [French] [ACD/IUPAC Name]
N-(4-Fluorphenyl)-7-[4-(trifluormethyl)phenyl]-4,7-dihydrothieno[2,3-c]pyridin-6(5H)-carboxamid [German] [ACD/IUPAC Name]
Thieno[2,3-c]pyridine-6(5H)-carboxamide, N-(4-fluorophenyl)-4,7-dihydro-7-[4-(trifluoromethyl)phenyl]- [ACD/Index 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: 563.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.7±3.0 kJ/mol
Flash Point: 294.4±30.1 °C
Index of Refraction: 1.613
Molar Refractivity: 103.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.65
ACD/LogD (pH 5.5): 5.08
ACD/BCF (pH 5.5): 4304.93
ACD/KOC (pH 5.5): 13892.66
ACD/LogD (pH 7.4): 5.08
ACD/BCF (pH 7.4): 4304.61
ACD/KOC (pH 7.4): 13891.63
Polar Surface Area: 61 Å2
Polarizability: 41.0±0.5 10-24cm3
Surface Tension: 50.4±3.0 dyne/cm
Molar Volume: 297.3±3.0 cm3

Click to predict properties on the Chemicalize site


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