ChemSpider 2D Image | 2-Methyl-2-propanyl {1-[(2-hydroxyethyl){1-(4-hydroxy-3-methylphenyl)-2-[(4-methoxyphenyl)amino]-2-oxoethyl}amino]-4-(methylsulfanyl)-1-oxo-2-butanyl}carbamate | C28H39N3O7S

2-Methyl-2-propanyl {1-[(2-hydroxyethyl){1-(4-hydroxy-3-methylphenyl)-2-[(4-methoxyphenyl)amino]-2-oxoethyl}amino]-4-(methylsulfanyl)-1-oxo-2-butanyl}carbamate

  • Molecular FormulaC28H39N3O7S
  • Average mass561.690 Da
  • Monoisotopic mass561.250854 Da
  • ChemSpider ID16518934

More details:

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

{1-[(2-Hydroxyéthyl){1-(4-hydroxy-3-méthylphényl)-2-[(4-méthoxyphényl)amino]-2-oxoéthyl}amino]-4-(méthylsulfanyl)-1-oxo-2-butanyl}carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl {1-[(2-hydroxyethyl){1-(4-hydroxy-3-methylphenyl)-2-[(4-methoxyphenyl)amino]-2-oxoethyl}amino]-4-(methylsulfanyl)-1-oxo-2-butanyl}carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-{1-[(2-hydroxyethyl){1-(4-hydroxy-3-methylphenyl)-2-[(4-methoxyphenyl)amino]-2-oxoethyl}amino]-4-(methylsulfanyl)-1-oxo-2-butanyl}carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[1-[[(2-hydroxyethyl)[1-(4-hydroxy-3-methylphenyl)-2-[(4-methoxyphenyl)amino]-2-oxoethyl]amino]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: 1.570
Molar Refractivity: 150.8±0.5 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 3
ACD/LogP: 5.16
ACD/LogD (pH 5.5): 3.40
ACD/BCF (pH 5.5): 224.34
ACD/KOC (pH 5.5): 1671.85
ACD/LogD (pH 7.4): 3.31
ACD/BCF (pH 7.4): 182.76
ACD/KOC (pH 7.4): 1362.02
Polar Surface Area: 166 Å2
Polarizability: 59.8±0.5 10-24cm3
Surface Tension: 44.2±7.0 dyne/cm
Molar Volume: 459.9±7.0 cm3

Click to predict properties on the Chemicalize site


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