ChemSpider 2D Image | 3-{4-[2-(2,3-Dihydro-1-benzofuran-5-yl)ethoxy]-3-methoxyphenyl}-3-[3-hydroxy-4-oxo-6-(1-piperidinylmethyl)-4H-pyran-2-yl]propanamide | C31H36N2O7

3-{4-[2-(2,3-Dihydro-1-benzofuran-5-yl)ethoxy]-3-methoxyphenyl}-3-[3-hydroxy-4-oxo-6-(1-piperidinylmethyl)-4H-pyran-2-yl]propanamide

  • Molecular FormulaC31H36N2O7
  • Average mass548.627 Da
  • Monoisotopic mass548.252258 Da
  • ChemSpider ID35147156

More details:

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

3-{4-[2-(2,3-Dihydro-1-benzofuran-5-yl)ethoxy]-3-methoxyphenyl}-3-[3-hydroxy-4-oxo-6-(1-piperidinylmethyl)-4H-pyran-2-yl]propanamid [German] [ACD/IUPAC Name]
3-{4-[2-(2,3-Dihydro-1-benzofuran-5-yl)ethoxy]-3-methoxyphenyl}-3-[3-hydroxy-4-oxo-6-(1-piperidinylmethyl)-4H-pyran-2-yl]propanamide [ACD/IUPAC Name]
3-{4-[2-(2,3-Dihydro-1-benzofuran-5-yl)éthoxy]-3-méthoxyphényl}-3-[3-hydroxy-4-oxo-6-(1-pipéridinylméthyl)-4H-pyran-2-yl]propanamide [French] [ACD/IUPAC Name]
4H-Pyran-2-propanamide, β-[4-[2-(2,3-dihydro-5-benzofuranyl)ethoxy]-3-methoxyphenyl]-3-hydroxy-4-oxo-6-(1-piperidinylmethyl)- [ACD/Index Name]
3-(4-(2-(2,3-dihydrobenzofuran-5-yl)ethoxy)-3-methoxyphenyl)-3-(3-hydroxy-4-oxo-6-(piperidin-1-ylmethyl)-4H-pyran-2-yl)propanamide

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

Density: 1.3±0.1 g/cm3
Boiling Point: 796.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 121.5±3.0 kJ/mol
Flash Point: 435.6±32.9 °C
Index of Refraction: 1.624
Molar Refractivity: 148.5±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 3.93
ACD/LogD (pH 5.5): -0.30
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.56
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.90
Polar Surface Area: 121 Å2
Polarizability: 58.9±0.5 10-24cm3
Surface Tension: 59.7±3.0 dyne/cm
Molar Volume: 420.9±3.0 cm3

Click to predict properties on the Chemicalize site


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