ChemSpider 2D Image | 2,2'-{1,5-Pentanediylbis[oxy-2,1-phenylenemethylene(5-methoxy-2-methyl-1H-indole-1,3-diyl)]}diacetamide | C43H48N4O6

2,2'-{1,5-Pentanediylbis[oxy-2,1-phenylenemethylene(5-methoxy-2-methyl-1H-indole-1,3-diyl)]}diacetamide

  • Molecular FormulaC43H48N4O6
  • Average mass716.864 Da
  • Monoisotopic mass716.357361 Da
  • ChemSpider ID24687814

More details:

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

1H-Indole-3-acetamide, 1,1'-[1,5-pentanediylbis(oxy-2,1-phenylenemethylene)]bis[5-methoxy-2-methyl- [ACD/Index Name]
2,2'-{1,5-Pentandiylbis[oxy-2,1-phenylenmethylen(5-methoxy-2-methyl-1H-indol-1,3-diyl)]}diacetamid [German] [ACD/IUPAC Name]
2,2'-{1,5-Pentanediylbis[oxy-2,1-phenylenemethylene(5-methoxy-2-methyl-1H-indole-1,3-diyl)]}diacetamide [ACD/IUPAC Name]
2,2'-{1,5-Pentanediylbis[oxy-2,1-phénylèneméthylène(5-méthoxy-2-méthyl-1H-indole-1,3-diyl)]}diacétamide [French] [ACD/IUPAC Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL452380/

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

Density: 1.2±0.1 g/cm3
Boiling Point: 986.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 144.0±3.0 kJ/mol
Flash Point: 550.3±34.3 °C
Index of Refraction: 1.615
Molar Refractivity: 203.7±0.5 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 3
ACD/LogP: 6.38
ACD/LogD (pH 5.5): 6.64
ACD/BCF (pH 5.5): 65073.99
ACD/KOC (pH 5.5): 97054.94
ACD/LogD (pH 7.4): 6.64
ACD/BCF (pH 7.4): 65074.06
ACD/KOC (pH 7.4): 97055.05
Polar Surface Area: 133 Å2
Polarizability: 80.8±0.5 10-24cm3
Surface Tension: 46.7±7.0 dyne/cm
Molar Volume: 584.0±7.0 cm3

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