ChemSpider 2D Image | Methyl N-{[(2-hydroxyethyl)(N-{[(2-methyl-2-propanyl)oxy]carbonyl}leucyl)amino](4-hydroxy-3-methylphenyl)acetyl}glycinate | C25H39N3O8

Methyl N-{[(2-hydroxyethyl)(N-{[(2-methyl-2-propanyl)oxy]carbonyl}leucyl)amino](4-hydroxy-3-methylphenyl)acetyl}glycinate

  • Molecular FormulaC25H39N3O8
  • Average mass509.592 Da
  • Monoisotopic mass509.273712 Da
  • ChemSpider ID16536037

More details:

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

Glycine, N-[2-[[2-[[(1,1-dimethylethoxy)carbonyl]amino]-4-methyl-1-oxopentyl](2-hydroxyethyl)amino]-2-(4-hydroxy-3-methylphenyl)acetyl]-, methyl ester [ACD/Index Name]
Methyl N-{[(2-hydroxyethyl)(N-{[(2-methyl-2-propanyl)oxy]carbonyl}leucyl)amino](4-hydroxy-3-methylphenyl)acetyl}glycinate [ACD/IUPAC Name]
Methyl-N-{[(2-hydroxyethyl)(N-{[(2-methyl-2-propanyl)oxy]carbonyl}leucyl)amino](4-hydroxy-3-methylphenyl)acetyl}glycinat [German] [ACD/IUPAC Name]
N-{2-[(2-Hydroxyéthyl)(N-{[(2-méthyl-2-propanyl)oxy]carbonyl}leucyl)amino]-2-(4-hydroxy-3-méthylphényl)acétyl}glycinate de méthyle [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 679.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 104.7±3.0 kJ/mol
Flash Point: 364.5±34.3 °C
Index of Refraction: 1.540
Molar Refractivity: 132.4±0.5 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 3
ACD/LogP: 5.08
ACD/LogD (pH 5.5): 3.10
ACD/BCF (pH 5.5): 130.55
ACD/KOC (pH 5.5): 1112.90
ACD/LogD (pH 7.4): 2.81
ACD/BCF (pH 7.4): 67.09
ACD/KOC (pH 7.4): 571.93
Polar Surface Area: 161 Å2
Polarizability: 52.5±0.5 10-24cm3
Surface Tension: 41.7±7.0 dyne/cm
Molar Volume: 422.2±7.0 cm3

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