ChemSpider 2D Image | N-{2-(Dimethylamino)-2-[4-(trifluoromethyl)phenyl]ethyl}-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide | C22H22F3N3O3

N-{2-(Dimethylamino)-2-[4-(trifluoromethyl)phenyl]ethyl}-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide

  • Molecular FormulaC22H22F3N3O3
  • Average mass433.424 Da
  • Monoisotopic mass433.161316 Da
  • ChemSpider ID21859501

More details:

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

3-Isoxazolecarboxamide, N-[2-(dimethylamino)-2-[4-(trifluoromethyl)phenyl]ethyl]-5-(4-methoxyphenyl)- [ACD/Index Name]
N-{2-(Dimethylamino)-2-[4-(trifluormethyl)phenyl]ethyl}-5-(4-methoxyphenyl)-1,2-oxazol-3-carboxamid [German] [ACD/IUPAC Name]
N-{2-(Dimethylamino)-2-[4-(trifluoromethyl)phenyl]ethyl}-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide [ACD/IUPAC Name]
N-{2-(Diméthylamino)-2-[4-(trifluorométhyl)phényl]éthyl}-5-(4-méthoxyphényl)-1,2-oxazole-3-carboxamide [French] [ACD/IUPAC Name]
1092341-79-1 [RN]
N-[2-(dimethylamino)-2-[4-(trifluoromethyl)phenyl]ethyl]-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide
N-{2-(dimethylamino)-2-[4-(trifluoromethyl)phenyl]ethyl}[5-(4-methoxyphenyl)isoxazol-3-yl]carboxamide

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

Density: 1.3±0.1 g/cm3
Boiling Point: 569.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.4±3.0 kJ/mol
Flash Point: 298.0±30.1 °C
Index of Refraction: 1.539
Molar Refractivity: 108.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.36
ACD/LogD (pH 5.5): 1.82
ACD/BCF (pH 5.5): 5.80
ACD/KOC (pH 5.5): 42.36
ACD/LogD (pH 7.4): 3.26
ACD/BCF (pH 7.4): 158.19
ACD/KOC (pH 7.4): 1156.30
Polar Surface Area: 68 Å2
Polarizability: 43.1±0.5 10-24cm3
Surface Tension: 39.9±3.0 dyne/cm
Molar Volume: 346.8±3.0 cm3

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