ChemSpider 2D Image | 4-{5-[(4-Methoxyphenoxy)methyl]-2-furyl}-2,7,7-trimethyl-N-(5-methyl-2-pyridinyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxamide | C31H33N3O5

4-{5-[(4-Methoxyphenoxy)methyl]-2-furyl}-2,7,7-trimethyl-N-(5-methyl-2-pyridinyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxamide

  • Molecular FormulaC31H33N3O5
  • Average mass527.611 Da
  • Monoisotopic mass527.242004 Da
  • ChemSpider ID4318405

More details:

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

3-Quinolinecarboxamide, 1,4,5,6,7,8-hexahydro-4-[5-[(4-methoxyphenoxy)methyl]-2-furanyl]-2,7,7-trimethyl-N-(5-methyl-2-pyridinyl)-5-oxo- [ACD/Index Name]
4-{5-[(4-Methoxyphenoxy)methyl]-2-furyl}-2,7,7-trimethyl-N-(5-methyl-2-pyridinyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-chinolincarboxamid [German] [ACD/IUPAC Name]
4-{5-[(4-Méthoxyphénoxy)méthyl]-2-furyl}-2,7,7-triméthyl-N-(5-méthyl-2-pyridinyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinoléinecarboxamide [French] [ACD/IUPAC Name]
4-{5-[(4-Methoxyphenoxy)methyl]-2-furyl}-2,7,7-trimethyl-N-(5-methyl-2-pyridinyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxamide [ACD/IUPAC Name]
4-[5-(4-Methoxy-phenoxymethyl)-furan-2-yl]-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-quinoline-3-carboxylic acid (5-methyl-pyridin-2-yl)-amide
4-{5-[(4-methoxyphenoxy)methyl]furan-2-yl}-2,7,7-trimethyl-N-(5-methylpyridin-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide

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

Density: 1.3±0.1 g/cm3
Boiling Point: 736.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 107.5±3.0 kJ/mol
Flash Point: 399.3±32.9 °C
Index of Refraction: 1.626
Molar Refractivity: 146.4±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 4.04
ACD/LogD (pH 5.5): 4.72
ACD/BCF (pH 5.5): 2258.66
ACD/KOC (pH 5.5): 8707.47
ACD/LogD (pH 7.4): 4.73
ACD/BCF (pH 7.4): 2302.05
ACD/KOC (pH 7.4): 8874.75
Polar Surface Area: 103 Å2
Polarizability: 58.0±0.5 10-24cm3
Surface Tension: 58.1±5.0 dyne/cm
Molar Volume: 413.2±5.0 cm3

Click to predict properties on the Chemicalize site


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