ChemSpider 2D Image | N-{2-[(4-Methoxyphenyl)sulfonyl]-2-(2-thienyl)ethyl}-3,5-dimethyl-1,2-oxazole-4-sulfonamide | C18H20N2O6S3

N-{2-[(4-Methoxyphenyl)sulfonyl]-2-(2-thienyl)ethyl}-3,5-dimethyl-1,2-oxazole-4-sulfonamide

  • Molecular FormulaC18H20N2O6S3
  • Average mass456.556 Da
  • Monoisotopic mass456.048340 Da
  • ChemSpider ID65950027

More details:

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

4-Isoxazolesulfonamide, N-[2-[(4-methoxyphenyl)sulfonyl]-2-(2-thienyl)ethyl]-3,5-dimethyl- [ACD/Index Name]
N-{2-[(4-Methoxyphenyl)sulfonyl]-2-(2-thienyl)ethyl}-3,5-dimethyl-1,2-oxazol-4-sulfonamid [German] [ACD/IUPAC Name]
N-{2-[(4-Methoxyphenyl)sulfonyl]-2-(2-thienyl)ethyl}-3,5-dimethyl-1,2-oxazole-4-sulfonamide [ACD/IUPAC Name]
N-{2-[(4-Méthoxyphényl)sulfonyl]-2-(2-thiényl)éthyl}-3,5-diméthyl-1,2-oxazole-4-sulfonamide [French] [ACD/IUPAC 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: 708.3±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 103.6±3.0 kJ/mol
Flash Point: 382.2±35.7 °C
Index of Refraction: 1.594
Molar Refractivity: 110.7±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.45
ACD/LogD (pH 5.5): 2.37
ACD/BCF (pH 5.5): 37.36
ACD/KOC (pH 5.5): 464.49
ACD/LogD (pH 7.4): 2.32
ACD/BCF (pH 7.4): 33.35
ACD/KOC (pH 7.4): 414.66
Polar Surface Area: 161 Å2
Polarizability: 43.9±0.5 10-24cm3
Surface Tension: 54.9±3.0 dyne/cm
Molar Volume: 326.2±3.0 cm3

Click to predict properties on the Chemicalize site


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