ChemSpider 2D Image | N-sec-Butyl-N-{2-[(4-methoxyphenyl)amino]-1-(2-methylphenyl)-2-oxoethyl}-N~2~-{[(2-methyl-2-propanyl)oxy]carbonyl}leucinamide | C31H45N3O5

N-sec-Butyl-N-{2-[(4-methoxyphenyl)amino]-1-(2-methylphenyl)-2-oxoethyl}-N2-{[(2-methyl-2-propanyl)oxy]carbonyl}leucinamide

  • Molecular FormulaC31H45N3O5
  • Average mass539.706 Da
  • Monoisotopic mass539.335938 Da
  • ChemSpider ID16537789

More details:

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

Carbamic acid, N-[1-[[[2-[(4-methoxyphenyl)amino]-1-(2-methylphenyl)-2-oxoethyl](1-methylpropyl)amino]carbonyl]-3-methylbutyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
N-sec-Butyl-N-{2-[(4-methoxyphenyl)amino]-1-(2-methylphenyl)-2-oxoethyl}-N2-{[(2-methyl-2-propanyl)oxy]carbonyl}leucinamid [German] [ACD/IUPAC Name]
N-sec-Butyl-N-{2-[(4-methoxyphenyl)amino]-1-(2-methylphenyl)-2-oxoethyl}-N2-{[(2-methyl-2-propanyl)oxy]carbonyl}leucinamide [ACD/IUPAC Name]
N-sec-Butyl-N-{2-[(4-méthoxyphényl)amino]-1-(2-méthylphényl)-2-oxoéthyl}-N2-{[(2-méthyl-2-propanyl)oxy]carbonyl}leucinamide [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.535
Molar Refractivity: 154.6±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 7.54
ACD/LogD (pH 5.5): 5.45
ACD/BCF (pH 5.5): 8183.83
ACD/KOC (pH 5.5): 21931.18
ACD/LogD (pH 7.4): 5.40
ACD/BCF (pH 7.4): 7254.76
ACD/KOC (pH 7.4): 19441.43
Polar Surface Area: 100 Å2
Polarizability: 61.3±0.5 10-24cm3
Surface Tension: 36.2±7.0 dyne/cm
Molar Volume: 496.4±7.0 cm3

Click to predict properties on the Chemicalize site


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