ChemSpider 2D Image | N-{2-[(2-Chloro-6-methylphenyl)amino]-1-(4-hydroxyphenyl)-2-oxoethyl}-N-isopropyl-Nalpha-{[(2-methyl-2-propanyl)oxy]carbonyl}tyrosinamide | C32H38ClN3O6

N-{2-[(2-Chloro-6-methylphenyl)amino]-1-(4-hydroxyphenyl)-2-oxoethyl}-N-isopropyl-Nα-{[(2-methyl-2-propanyl)oxy]carbonyl}tyrosinamide

  • Molecular FormulaC32H38ClN3O6
  • Average mass596.114 Da
  • Monoisotopic mass595.244934 Da
  • ChemSpider ID16559222

More details:

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

Carbamic acid, N-[2-[[2-[(2-chloro-6-methylphenyl)amino]-1-(4-hydroxyphenyl)-2-oxoethyl](1-methylethyl)amino]-1-[(4-hydroxyphenyl)methyl]-2-oxoethyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
N-{2-[(2-Chlor-6-methylphenyl)amino]-1-(4-hydroxyphenyl)-2-oxoethyl}-N-isopropyl-Nα-{[(2-methyl-2-propanyl)oxy]carbonyl}tyrosinamid [German] [ACD/IUPAC Name]
N-{2-[(2-Chloro-6-methylphenyl)amino]-1-(4-hydroxyphenyl)-2-oxoethyl}-N-isopropyl-Nα-{[(2-methyl-2-propanyl)oxy]carbonyl}tyrosinamide [ACD/IUPAC Name]
N-{2-[(2-Chloro-6-méthylphényl)amino]-1-(4-hydroxyphényl)-2-oxoéthyl}-N-isopropyl-Nα-{[(2-méthyl-2-propanyl)oxy]carbonyl}tyrosinamide [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: 799.3±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 121.9±3.0 kJ/mol
Flash Point: 437.2±35.7 °C
Index of Refraction: 1.585
Molar Refractivity: 162.1±0.5 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 7.45
ACD/LogD (pH 5.5): 4.88
ACD/BCF (pH 5.5): 2911.57
ACD/KOC (pH 5.5): 10014.73
ACD/LogD (pH 7.4): 4.15
ACD/BCF (pH 7.4): 536.19
ACD/KOC (pH 7.4): 1844.31
Polar Surface Area: 135 Å2
Polarizability: 64.3±0.5 10-24cm3
Surface Tension: 43.9±7.0 dyne/cm
Molar Volume: 483.8±7.0 cm3

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