ChemSpider 2D Image | N-sec-Butyl-N-[1-(3-methylphenyl)-2-oxo-2-(pentylamino)ethyl]-N~2~-{[(2-methyl-2-propanyl)oxy]carbonyl}leucinamide | C29H49N3O4

N-sec-Butyl-N-[1-(3-methylphenyl)-2-oxo-2-(pentylamino)ethyl]-N2-{[(2-methyl-2-propanyl)oxy]carbonyl}leucinamide

  • Molecular FormulaC29H49N3O4
  • Average mass503.717 Da
  • Monoisotopic mass503.372314 Da
  • ChemSpider ID16537797

More details:






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

Carbamic acid, N-[3-methyl-1-[[[1-(3-methylphenyl)-2-oxo-2-(pentylamino)ethyl](1-methylpropyl)amino]carbonyl]butyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
N-sec-Butyl-N-[1-(3-methylphenyl)-2-oxo-2-(pentylamino)ethyl]-N2-{[(2-methyl-2-propanyl)oxy]carbonyl}leucinamid [German] [ACD/IUPAC Name]
N-sec-Butyl-N-[1-(3-methylphenyl)-2-oxo-2-(pentylamino)ethyl]-N2-{[(2-methyl-2-propanyl)oxy]carbonyl}leucinamide [ACD/IUPAC Name]
N-sec-Butyl-N-[1-(3-méthylphényl)-2-oxo-2-(pentylamino)éthyl]-N2-{[(2-méthyl-2-propanyl)oxy]carbonyl}leucinamide [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.0±0.1 g/cm3
Boiling Point: 624.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 97.2±3.0 kJ/mol
Flash Point: 331.3±34.3 °C
Index of Refraction: 1.514
Molar Refractivity: 146.5±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 2
ACD/LogP: 8.73
ACD/LogD (pH 5.5): 5.91
ACD/BCF (pH 5.5): 12078.38
ACD/KOC (pH 5.5): 17638.01
ACD/LogD (pH 7.4): 5.86
ACD/BCF (pH 7.4): 10752.95
ACD/KOC (pH 7.4): 15702.48
Polar Surface Area: 95 Å2
Polarizability: 58.1±0.5 10-24cm3
Surface Tension: 34.2±7.0 dyne/cm
Molar Volume: 486.5±7.0 cm3

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