ChemSpider 2D Image | N-{2-(Diethylamino)-2-[4-(2-methyl-2-propanyl)phenyl]ethyl}-5-(2-thienyl)-1,2-oxazole-3-carboxamide | C24H31N3O2S

N-{2-(Diethylamino)-2-[4-(2-methyl-2-propanyl)phenyl]ethyl}-5-(2-thienyl)-1,2-oxazole-3-carboxamide

  • Molecular FormulaC24H31N3O2S
  • Average mass425.587 Da
  • Monoisotopic mass425.213684 Da
  • ChemSpider ID21859380

More details:

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

3-Isoxazolecarboxamide, N-[2-(diethylamino)-2-[4-(1,1-dimethylethyl)phenyl]ethyl]-5-(2-thienyl)- [ACD/Index Name]
N-{2-(Diethylamino)-2-[4-(2-methyl-2-propanyl)phenyl]ethyl}-5-(2-thienyl)-1,2-oxazol-3-carboxamid [German] [ACD/IUPAC Name]
N-{2-(Diethylamino)-2-[4-(2-methyl-2-propanyl)phenyl]ethyl}-5-(2-thienyl)-1,2-oxazole-3-carboxamide [ACD/IUPAC Name]
N-{2-(Diéthylamino)-2-[4-(2-méthyl-2-propanyl)phényl]éthyl}-5-(2-thiényl)-1,2-oxazole-3-carboxamide [French] [ACD/IUPAC Name]
N-[2-(4-tert-butylphenyl)-2-(diethylamino)ethyl]-5-(thiophen-2-yl)-1,2-oxazole-3-carboxamide
N-[2-(4-tert-butylphenyl)-2-(diethylamino)ethyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide
N-{2-(diethylamino)-2-[4-(tert-butyl)phenyl]ethyl}(5-(2-thienyl)isoxazol-3-yl)carboxamide

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

Density: 1.1±0.1 g/cm3
Boiling Point: 583.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.2±3.0 kJ/mol
Flash Point: 306.4±30.1 °C
Index of Refraction: 1.563
Molar Refractivity: 123.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 5.52
ACD/LogD (pH 5.5): 1.96
ACD/BCF (pH 5.5): 3.88
ACD/KOC (pH 5.5): 14.64
ACD/LogD (pH 7.4): 3.54
ACD/BCF (pH 7.4): 144.82
ACD/KOC (pH 7.4): 546.42
Polar Surface Area: 87 Å2
Polarizability: 48.8±0.5 10-24cm3
Surface Tension: 42.9±3.0 dyne/cm
Molar Volume: 378.5±3.0 cm3

Click to predict properties on the Chemicalize site


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