ChemSpider 2D Image | N-[2-(Diethylamino)-2-(4-isopropylphenyl)ethyl]-5-(2-thienyl)-1,2-oxazole-3-carboxamide | C23H29N3O2S

N-[2-(Diethylamino)-2-(4-isopropylphenyl)ethyl]-5-(2-thienyl)-1,2-oxazole-3-carboxamide

  • Molecular FormulaC23H29N3O2S
  • Average mass411.560 Da
  • Monoisotopic mass411.198059 Da
  • ChemSpider ID21860083

More details:

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

3-Isoxazolecarboxamide, N-[2-(diethylamino)-2-[4-(1-methylethyl)phenyl]ethyl]-5-(2-thienyl)- [ACD/Index Name]
N-[2-(Diethylamino)-2-(4-isopropylphenyl)ethyl]-5-(2-thienyl)-1,2-oxazol-3-carboxamid [German] [ACD/IUPAC Name]
N-[2-(Diethylamino)-2-(4-isopropylphenyl)ethyl]-5-(2-thienyl)-1,2-oxazole-3-carboxamide [ACD/IUPAC Name]
N-[2-(Diéthylamino)-2-(4-isopropylphényl)éthyl]-5-(2-thiényl)-1,2-oxazole-3-carboxamide [French] [ACD/IUPAC Name]
1092334-92-3 [RN]
N-[2-(diethylamino)-2-(4-propan-2-ylphenyl)ethyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide
N-[2-(diethylamino)-2-[4-(propan-2-yl)phenyl]ethyl]-5-(thiophen-2-yl)-1,2-oxazole-3-carboxamide
N-{2-(diethylamino)-2-[4-(methylethyl)phenyl]ethyl}(5-(2-thienyl)isoxazol-3-yl)carboxamide
N-{2-(diethylamino)-2-[4-(propan-2-yl)phenyl]ethyl}-5-(thiophen-2-yl)-1,2-oxazole-3-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: 574.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.1±3.0 kJ/mol
Flash Point: 301.4±30.1 °C
Index of Refraction: 1.570
Molar Refractivity: 118.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 5.17
ACD/LogD (pH 5.5): 1.60
ACD/BCF (pH 5.5): 2.07
ACD/KOC (pH 5.5): 9.44
ACD/LogD (pH 7.4): 3.18
ACD/BCF (pH 7.4): 80.03
ACD/KOC (pH 7.4): 365.81
Polar Surface Area: 87 Å2
Polarizability: 47.1±0.5 10-24cm3
Surface Tension: 44.7±3.0 dyne/cm
Molar Volume: 361.9±3.0 cm3

Click to predict properties on the Chemicalize site


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