ChemSpider 2D Image | 2-Methyl-2-propanyl (4-amino-1-{[2-(benzylamino)-1-(4-hydroxyphenyl)-2-oxoethyl](2-methyl-2-butanyl)amino}-1,4-dioxo-2-butanyl)carbamate | C29H40N4O6

2-Methyl-2-propanyl (4-amino-1-{[2-(benzylamino)-1-(4-hydroxyphenyl)-2-oxoethyl](2-methyl-2-butanyl)amino}-1,4-dioxo-2-butanyl)carbamate

  • Molecular FormulaC29H40N4O6
  • Average mass540.651 Da
  • Monoisotopic mass540.294800 Da
  • ChemSpider ID16544114

More details:

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

(4-Amino-1-{[2-(benzylamino)-1-(4-hydroxyphényl)-2-oxoéthyl](2-méthyl-2-butanyl)amino}-1,4-dioxo-2-butanyl)carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl (4-amino-1-{[2-(benzylamino)-1-(4-hydroxyphenyl)-2-oxoethyl](2-methyl-2-butanyl)amino}-1,4-dioxo-2-butanyl)carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(4-amino-1-{[2-(benzylamino)-1-(4-hydroxyphenyl)-2-oxoethyl](2-methyl-2-butanyl)amino}-1,4-dioxo-2-butanyl)carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[3-amino-1-[[(1,1-dimethylpropyl)[1-(4-hydroxyphenyl)-2-oxo-2-[(phenylmethyl)amino]ethyl]amino]carbonyl]-3-oxopropyl]-, 1,1-dimethylethyl ester [ACD/Index 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: 721.3±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 110.6±3.0 kJ/mol
Flash Point: 390.1±35.7 °C
Index of Refraction: 1.564
Molar Refractivity: 148.7±0.5 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 4
ACD/LogP: 5.74
ACD/LogD (pH 5.5): 1.33
ACD/BCF (pH 5.5): 1.50
ACD/KOC (pH 5.5): 9.02
ACD/LogD (pH 7.4): 1.12
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.66
Polar Surface Area: 159 Å2
Polarizability: 58.9±0.5 10-24cm3
Surface Tension: 44.0±7.0 dyne/cm
Molar Volume: 457.1±7.0 cm3

Click to predict properties on the Chemicalize site


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