ChemSpider 2D Image | 4-(3,4-Dimethoxybenzoyl)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-5-{3-methoxy-4-[2-(4-morpholinyl)ethoxy]phenyl}-1,5-dihydro-2H-pyrrol-2-one | C36H39N3O8

4-(3,4-Dimethoxybenzoyl)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-5-{3-methoxy-4-[2-(4-morpholinyl)ethoxy]phenyl}-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC36H39N3O8
  • Average mass641.710 Da
  • Monoisotopic mass641.273743 Da
  • ChemSpider ID117926346

More details:

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

2H-Pyrrol-2-one, 4-(3,4-dimethoxybenzoyl)-1,5-dihydro-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-5-[3-methoxy-4-[2-(4-morpholinyl)ethoxy]phenyl]- [ACD/Index Name]
4-(3,4-Dimethoxybenzoyl)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-5-{3-methoxy-4-[2-(4-morpholinyl)ethoxy]phenyl}-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
4-(3,4-Dimethoxybenzoyl)-3-hydroxy-1-[2-(1H-indol-3-yl)ethyl]-5-{3-methoxy-4-[2-(4-morpholinyl)ethoxy]phenyl}-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
4-(3,4-Diméthoxybenzoyl)-3-hydroxy-1-[2-(1H-indol-3-yl)éthyl]-5-{3-méthoxy-4-[2-(4-morpholinyl)éthoxy]phényl}-1,5-dihydro-2H-pyrrol-2-one [French] [ACD/IUPAC 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: 866.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 132.0±3.0 kJ/mol
Flash Point: 478.1±34.3 °C
Index of Refraction: 1.637
Molar Refractivity: 176.5±0.3 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 4.18
ACD/LogD (pH 5.5): 1.24
ACD/BCF (pH 5.5): 1.78
ACD/KOC (pH 5.5): 15.15
ACD/LogD (pH 7.4): 0.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.09
Polar Surface Area: 123 Å2
Polarizability: 70.0±0.5 10-24cm3
Surface Tension: 57.3±3.0 dyne/cm
Molar Volume: 491.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement