ChemSpider 2D Image | N-Benzyl-N-methyl-2-(4-{[3-(trifluoromethyl)benzyl]oxy}phenyl)-1,3-thiazole-4-carboxamide | C26H21F3N2O2S

N-Benzyl-N-methyl-2-(4-{[3-(trifluoromethyl)benzyl]oxy}phenyl)-1,3-thiazole-4-carboxamide

  • Molecular FormulaC26H21F3N2O2S
  • Average mass482.517 Da
  • Monoisotopic mass482.127594 Da
  • ChemSpider ID22718950

More details:

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

4-Thiazolecarboxamide, N-methyl-N-(phenylmethyl)-2-[4-[[3-(trifluoromethyl)phenyl]methoxy]phenyl]- [ACD/Index Name]
N-Benzyl-N-methyl-2-(4-{[3-(trifluormethyl)benzyl]oxy}phenyl)-1,3-thiazol-4-carboxamid [German] [ACD/IUPAC Name]
N-Benzyl-N-methyl-2-(4-{[3-(trifluoromethyl)benzyl]oxy}phenyl)-1,3-thiazole-4-carboxamide [ACD/IUPAC Name]
N-Benzyl-N-méthyl-2-(4-{[3-(trifluorométhyl)benzyl]oxy}phényl)-1,3-thiazole-4-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 618.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.7±3.0 kJ/mol
Flash Point: 327.8±34.3 °C
Index of Refraction: 1.595
Molar Refractivity: 126.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.63
ACD/LogD (pH 5.5): 5.38
ACD/BCF (pH 5.5): 7252.36
ACD/KOC (pH 5.5): 20179.93
ACD/LogD (pH 7.4): 5.38
ACD/BCF (pH 7.4): 7252.49
ACD/KOC (pH 7.4): 20180.29
Polar Surface Area: 71 Å2
Polarizability: 50.1±0.5 10-24cm3
Surface Tension: 45.8±3.0 dyne/cm
Molar Volume: 371.6±3.0 cm3

Click to predict properties on the Chemicalize site


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