ChemSpider 2D Image | 1-[3-(Dimethylamino)propyl]-5-[3-ethoxy-4-(pentyloxy)phenyl]-3-hydroxy-4-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one | C32H42N2O6

1-[3-(Dimethylamino)propyl]-5-[3-ethoxy-4-(pentyloxy)phenyl]-3-hydroxy-4-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC32H42N2O6
  • Average mass550.686 Da
  • Monoisotopic mass550.304260 Da
  • ChemSpider ID21677106

More details:

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

1-[3-(Dimethylamino)propyl]-5-[3-ethoxy-4-(pentyloxy)phenyl]-3-hydroxy-4-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)carbonyl]-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
1-[3-(Dimethylamino)propyl]-5-[3-ethoxy-4-(pentyloxy)phenyl]-3-hydroxy-4-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
1-[3-(Diméthylamino)propyl]-5-[3-éthoxy-4-(pentyloxy)phényl]-3-hydroxy-4-[(2-méthyl-2,3-dihydro-1-benzofuran-5-yl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one [French] [ACD/IUPAC Name]
2H-Pyrrol-2-one, 4-[(2,3-dihydro-2-methyl-5-benzofuranyl)carbonyl]-1-[3-(dimethylamino)propyl]-5-[3-ethoxy-4-(pentyloxy)phenyl]-1,5-dihydro-3-hydroxy- [ACD/Index Name]
1-(3-(dimethylamino)propyl)-5-(3-ethoxy-4-(pentyloxy)phenyl)-3-hydroxy-4-(2-methyl-2,3-dihydrobenzofuran-5-carbonyl)-1H-pyrrol-2(5H)-one
1-(3-Dimethylamino-propyl)-5-(3-ethoxy-4-pentyloxy-phenyl)-3-hydroxy-4-(2-methyl-2,3-dihydro-benzofuran-5-carbonyl)-1,5-dihydro-pyrrol-2-one
1-[3-(dimethylamino)propyl]-5-(3-ethoxy-4-pentyloxyphenyl)-3-hydroxy-4-[(2-methyl(2,3-dihydrobenzo[b]furan-5-yl))carbonyl]-3-pyrrolin-2-one
848061-55-2 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 703.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 108.1±3.0 kJ/mol
Flash Point: 379.5±32.9 °C
Index of Refraction: 1.574
Molar Refractivity: 154.8±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 6.14
ACD/LogD (pH 5.5): 2.58
ACD/BCF (pH 5.5): 13.29
ACD/KOC (pH 5.5): 42.36
ACD/LogD (pH 7.4): 2.61
ACD/BCF (pH 7.4): 14.13
ACD/KOC (pH 7.4): 45.05
Polar Surface Area: 89 Å2
Polarizability: 61.4±0.5 10-24cm3
Surface Tension: 47.4±3.0 dyne/cm
Molar Volume: 468.7±3.0 cm3

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