ChemSpider 2D Image | 4-Methyl-N-[2-({2-[4-(2-methyl-2-propanyl)phenoxy]ethyl}amino)-1,2-diphenylethyl]benzenesulfonamide | C33H38N2O3S

4-Methyl-N-[2-({2-[4-(2-methyl-2-propanyl)phenoxy]ethyl}amino)-1,2-diphenylethyl]benzenesulfonamide

  • Molecular FormulaC33H38N2O3S
  • Average mass542.731 Da
  • Monoisotopic mass542.260315 Da
  • ChemSpider ID28611709

More details:

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

4-Methyl-N-[2-({2-[4-(2-methyl-2-propanyl)phenoxy]ethyl}amino)-1,2-diphenylethyl]benzenesulfonamide [ACD/IUPAC Name]
4-Méthyl-N-[2-({2-[4-(2-méthyl-2-propanyl)phénoxy]éthyl}amino)-1,2-diphényléthyl]benzènesulfonamide [French] [ACD/IUPAC Name]
4-Methyl-N-[2-({2-[4-(2-methyl-2-propanyl)phenoxy]ethyl}amino)-1,2-diphenylethyl]benzolsulfonamid [German] [ACD/IUPAC Name]
Benzenesulfonamide, N-[2-[[2-[4-(1,1-dimethylethyl)phenoxy]ethyl]amino]-1,2-diphenylethyl]-4-methyl- [ACD/Index Name]
N-(2-{[2-(4-tert-butylphenoxy)ethyl]amino}-1,2-diphenylethyl)-4-methylbenzene-1-sulfonamide
N-(2-{[2-(4-tert-butylphenoxy)ethyl]amino}-1,2-diphenylethyl)-4-methylbenzenesulfonamide
N-[2-[2-(4-tert-butylphenoxy)ethylamino]-1,2-diphenylethyl]-4-methylbenzenesulfonamide

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

Density: 1.1±0.1 g/cm3
Boiling Point: 681.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.0±3.0 kJ/mol
Flash Point: 365.8±34.3 °C
Index of Refraction: 1.594
Molar Refractivity: 160.4±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 8.59
ACD/LogD (pH 5.5): 6.07
ACD/BCF (pH 5.5): 10966.19
ACD/KOC (pH 5.5): 10526.93
ACD/LogD (pH 7.4): 7.39
ACD/BCF (pH 7.4): 227330.89
ACD/KOC (pH 7.4): 218224.94
Polar Surface Area: 76 Å2
Polarizability: 63.6±0.5 10-24cm3
Surface Tension: 46.0±3.0 dyne/cm
Molar Volume: 472.6±3.0 cm3

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