ChemSpider 2D Image | {(4S)-4-(Furo[3,2-b]pyridin-2-yl)-4-[(6-methoxy-1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]-2,5-dioxo-1,3-imidazolidinediyl}bis(methylene) bis(2,2-dimethylpropanoate) | C32H36N4O9

{(4S)-4-(Furo[3,2-b]pyridin-2-yl)-4-[(6-methoxy-1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]-2,5-dioxo-1,3-imidazolidinediyl}bis(methylene) bis(2,2-dimethylpropanoate)

  • Molecular FormulaC32H36N4O9
  • Average mass620.650 Da
  • Monoisotopic mass620.248230 Da
  • ChemSpider ID76789587

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

{(4S)-4-(Furo[3,2-b]pyridin-2-yl)-4-[(6-methoxy-1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]-2,5-dioxo-1,3-imidazolidindiyl}dimethylen-bis(2,2-dimethylpropanoat) [German] [ACD/IUPAC Name]
{(4S)-4-(Furo[3,2-b]pyridin-2-yl)-4-[(6-methoxy-1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]-2,5-dioxo-1,3-imidazolidinediyl}bis(methylene) bis(2,2-dimethylpropanoate) [ACD/IUPAC Name]
Bis(2,2-diméthylpropanoate) de {(4S)-4-(furo[3,2-b]pyridin-2-yl)-4-[(6-méthoxy-1-oxo-1,3-dihydro-2H-isoindol-2-yl)méthyl]-2,5-dioxo-1,3-imidazolidinediyl}diméthylène [French] [ACD/IUPAC Name]
Propanoic acid, 2,2-dimethyl-, [(4S)-4-[(1,3-dihydro-6-methoxy-1-oxo-2H-isoindol-2-yl)methyl]-4-furo[3,2-b]pyridin-2-yl-2,5-dioxo-1,3-imidazolidinediyl]bis(methylene) ester [ACD/Index 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: 733.9±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 107.1±3.0 kJ/mol
Flash Point: 397.6±35.7 °C
Index of Refraction: 1.589
Molar Refractivity: 159.9±0.3 cm3
#H bond acceptors: 13
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 3.68
ACD/LogD (pH 5.5): 3.81
ACD/BCF (pH 5.5): 459.57
ACD/KOC (pH 5.5): 2795.65
ACD/LogD (pH 7.4): 3.81
ACD/BCF (pH 7.4): 462.63
ACD/KOC (pH 7.4): 2814.30
Polar Surface Area: 149 Å2
Polarizability: 63.4±0.5 10-24cm3
Surface Tension: 54.0±3.0 dyne/cm
Molar Volume: 474.6±3.0 cm3

Click to predict properties on the Chemicalize site


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