ChemSpider 2D Image | Methyl 3-{2-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-6-methyl-4-oxo-1,4-dihydro-3-pyridinyl}-3-{2-[2-(4-methoxyphenyl)ethoxy]phenyl}propanoate | C35H36N2O6

Methyl 3-{2-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-6-methyl-4-oxo-1,4-dihydro-3-pyridinyl}-3-{2-[2-(4-methoxyphenyl)ethoxy]phenyl}propanoate

  • Molecular FormulaC35H36N2O6
  • Average mass580.670 Da
  • Monoisotopic mass580.257324 Da
  • ChemSpider ID65057631

More details:

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

3-{2-Hydroxy-1-[2-(1H-indol-3-yl)éthyl]-6-méthyl-4-oxo-1,4-dihydro-3-pyridinyl}-3-{2-[2-(4-méthoxyphényl)éthoxy]phényl}propanoate de méthyle [French] [ACD/IUPAC Name]
3-Pyridinepropanoic acid, 1,4-dihydro-2-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-β-[2-[2-(4-methoxyphenyl)ethoxy]phenyl]-6-methyl-4-oxo-, methyl ester [ACD/Index Name]
Methyl 3-{2-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-6-methyl-4-oxo-1,4-dihydro-3-pyridinyl}-3-{2-[2-(4-methoxyphenyl)ethoxy]phenyl}propanoate [ACD/IUPAC Name]
Methyl-3-{2-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-6-methyl-4-oxo-1,4-dihydro-3-pyridinyl}-3-{2-[2-(4-methoxyphenyl)ethoxy]phenyl}propanoat [German] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 792.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 120.8±3.0 kJ/mol
Flash Point: 432.9±32.9 °C
Index of Refraction: 1.640
Molar Refractivity: 165.7±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 6.30
ACD/LogD (pH 5.5): 4.94
ACD/BCF (pH 5.5): 2090.33
ACD/KOC (pH 5.5): 4717.31
ACD/LogD (pH 7.4): 3.20
ACD/BCF (pH 7.4): 38.20
ACD/KOC (pH 7.4): 86.20
Polar Surface Area: 101 Å2
Polarizability: 65.7±0.5 10-24cm3
Surface Tension: 56.9±3.0 dyne/cm
Molar Volume: 459.5±3.0 cm3

Click to predict properties on the Chemicalize site


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