ChemSpider 2D Image | 2-Methyl-2-propanyl {4-amino-1-[{2-[(2-chloro-6-methylphenyl)amino]-1-(4-hydroxyphenyl)-2-oxoethyl}(2-methyl-2-butanyl)amino]-1,4-dioxo-2-butanyl}carbamate | C29H39ClN4O6

2-Methyl-2-propanyl {4-amino-1-[{2-[(2-chloro-6-methylphenyl)amino]-1-(4-hydroxyphenyl)-2-oxoethyl}(2-methyl-2-butanyl)amino]-1,4-dioxo-2-butanyl}carbamate

  • Molecular FormulaC29H39ClN4O6
  • Average mass575.096 Da
  • Monoisotopic mass574.255798 Da
  • ChemSpider ID16544117

More details:

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

{4-Amino-1-[{2-[(2-chloro-6-méthylphényl)amino]-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-[(2-chloro-6-methylphenyl)amino]-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-[(2-chlor-6-methylphenyl)amino]-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-[[[2-[(2-chloro-6-methylphenyl)amino]-1-(4-hydroxyphenyl)-2-oxoethyl](1,1-dimethylpropyl)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: 756.6±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 115.7±3.0 kJ/mol
Flash Point: 411.4±35.7 °C
Index of Refraction: 1.572
Molar Refractivity: 153.1±0.5 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 4
ACD/LogP: 6.59
ACD/LogD (pH 5.5): 1.88
ACD/BCF (pH 5.5): 3.99
ACD/KOC (pH 5.5): 18.16
ACD/LogD (pH 7.4): 1.18
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.58
Polar Surface Area: 159 Å2
Polarizability: 60.7±0.5 10-24cm3
Surface Tension: 44.0±7.0 dyne/cm
Molar Volume: 465.5±7.0 cm3

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