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

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

  • Molecular FormulaC21H16F4N2OS
  • Average mass420.423 Da
  • Monoisotopic mass420.091949 Da
  • ChemSpider ID28507276

More details:

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

N-(3-Fluorophenyl)-4-[4-(trifluoromethyl)phenyl]-6,7-dihydrothieno[3,2-c]pyridine-5(4H)-carboxamide [ACD/IUPAC Name]
N-(3-Fluorophényl)-4-[4-(trifluorométhyl)phényl]-6,7-dihydrothiéno[3,2-c]pyridine-5(4H)-carboxamide [French] [ACD/IUPAC Name]
N-(3-Fluorphenyl)-4-[4-(trifluormethyl)phenyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-carboxamid [German] [ACD/IUPAC Name]
Thieno[3,2-c]pyridine-5(4H)-carboxamide, N-(3-fluorophenyl)-6,7-dihydro-4-[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: 559.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.2±3.0 kJ/mol
Flash Point: 292.4±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: 4.89
ACD/LogD (pH 5.5): 5.45
ACD/BCF (pH 5.5): 8106.74
ACD/KOC (pH 5.5): 21854.60
ACD/LogD (pH 7.4): 5.45
ACD/BCF (pH 7.4): 8106.45
ACD/KOC (pH 7.4): 21853.81
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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