ChemSpider 2D Image | 2-Methyl-2-propanyl {1-[{1-(2-hydroxyphenyl)-2-[(4-methoxyphenyl)amino]-2-oxoethyl}(propyl)amino]-4-(methylsulfanyl)-1-oxo-2-butanyl}carbamate | C28H39N3O6S

2-Methyl-2-propanyl {1-[{1-(2-hydroxyphenyl)-2-[(4-methoxyphenyl)amino]-2-oxoethyl}(propyl)amino]-4-(methylsulfanyl)-1-oxo-2-butanyl}carbamate

  • Molecular FormulaC28H39N3O6S
  • Average mass545.691 Da
  • Monoisotopic mass545.255981 Da
  • ChemSpider ID16518964

More details:

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

{1-[{1-(2-Hydroxyphényl)-2-[(4-méthoxyphényl)amino]-2-oxoéthyl}(propyl)amino]-4-(méthylsulfanyl)-1-oxo-2-butanyl}carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl {1-[{1-(2-hydroxyphenyl)-2-[(4-methoxyphenyl)amino]-2-oxoethyl}(propyl)amino]-4-(methylsulfanyl)-1-oxo-2-butanyl}carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-{1-[{1-(2-hydroxyphenyl)-2-[(4-methoxyphenyl)amino]-2-oxoethyl}(propyl)amino]-4-(methylsulfanyl)-1-oxo-2-butanyl}carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[1-[[[1-(2-hydroxyphenyl)-2-[(4-methoxyphenyl)amino]-2-oxoethyl]propylamino]carbonyl]-3-(methylthio)propyl]-, 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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.562
Molar Refractivity: 150.0±0.5 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 5.64
ACD/LogD (pH 5.5): 3.93
ACD/BCF (pH 5.5): 568.21
ACD/KOC (pH 5.5): 3251.08
ACD/LogD (pH 7.4): 3.84
ACD/BCF (pH 7.4): 460.92
ACD/KOC (pH 7.4): 2637.23
Polar Surface Area: 146 Å2
Polarizability: 59.5±0.5 10-24cm3
Surface Tension: 42.3±7.0 dyne/cm
Molar Volume: 462.6±7.0 cm3

Click to predict properties on the Chemicalize site


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