ChemSpider 2D Image | N-(4-{[Benzyl(propyl)amino]methyl}phenyl)-2-[4-(ethylsulfonyl)phenyl]acetamide | C27H32N2O3S

N-(4-{[Benzyl(propyl)amino]methyl}phenyl)-2-[4-(ethylsulfonyl)phenyl]acetamide

  • Molecular FormulaC27H32N2O3S
  • Average mass464.620 Da
  • Monoisotopic mass464.213348 Da
  • ChemSpider ID31129567

More details:

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

Benzeneacetamide, 4-(ethylsulfonyl)-N-[4-[[(phenylmethyl)propylamino]methyl]phenyl]- [ACD/Index Name]
N-(4-{[Benzyl(propyl)amino]methyl}phenyl)-2-[4-(ethylsulfonyl)phenyl]acetamid [German] [ACD/IUPAC Name]
N-(4-{[Benzyl(propyl)amino]methyl}phenyl)-2-[4-(ethylsulfonyl)phenyl]acetamide [ACD/IUPAC Name]
N-(4-{[Benzyl(propyl)amino]méthyl}phényl)-2-[4-(éthylsulfonyl)phényl]acétamide [French] [ACD/IUPAC Name]
NBH

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

Density: 1.2±0.1 g/cm3
Boiling Point: 666.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.0±3.0 kJ/mol
Flash Point: 357.2±31.5 °C
Index of Refraction: 1.602
Molar Refractivity: 134.3±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 4.12
ACD/LogD (pH 5.5): 1.42
ACD/BCF (pH 5.5): 1.84
ACD/KOC (pH 5.5): 10.81
ACD/LogD (pH 7.4): 3.13
ACD/BCF (pH 7.4): 93.57
ACD/KOC (pH 7.4): 550.51
Polar Surface Area: 75 Å2
Polarizability: 53.2±0.5 10-24cm3
Surface Tension: 51.2±3.0 dyne/cm
Molar Volume: 391.8±3.0 cm3

Click to predict properties on the Chemicalize site


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