ChemSpider 2D Image | 4-[4-(3,5-Dimethoxybenzyl)-1-piperazinyl]-2-[(1-methyl-1,2,3,4-tetrahydro-6-quinolinyl)methyl]-1H-isoindole-1,3(2H)-dione | C32H36N4O4

4-[4-(3,5-Dimethoxybenzyl)-1-piperazinyl]-2-[(1-methyl-1,2,3,4-tetrahydro-6-quinolinyl)methyl]-1H-isoindole-1,3(2H)-dione

  • Molecular FormulaC32H36N4O4
  • Average mass540.653 Da
  • Monoisotopic mass540.273682 Da
  • ChemSpider ID22195013

More details:






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

1H-Isoindole-1,3(2H)-dione, 4-[4-[(3,5-dimethoxyphenyl)methyl]-1-piperazinyl]-2-[(1,2,3,4-tetrahydro-1-methyl-6-quinolinyl)methyl]- [ACD/Index Name]
4-[4-(3,5-Dimethoxybenzyl)-1-piperazinyl]-2-[(1-methyl-1,2,3,4-tetrahydro-6-chinolinyl)methyl]-1H-isoindol-1,3(2H)-dion [German] [ACD/IUPAC Name]
4-[4-(3,5-Diméthoxybenzyl)-1-pipérazinyl]-2-[(1-méthyl-1,2,3,4-tétrahydro-6-quinoléinyl)méthyl]-1H-isoindole-1,3(2H)-dione [French] [ACD/IUPAC Name]
4-[4-(3,5-Dimethoxybenzyl)-1-piperazinyl]-2-[(1-methyl-1,2,3,4-tetrahydro-6-quinolinyl)methyl]-1H-isoindole-1,3(2H)-dione [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 728.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.3±3.0 kJ/mol
Flash Point: 394.3±32.9 °C
Index of Refraction: 1.636
Molar Refractivity: 153.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 4.61
ACD/LogD (pH 5.5): 3.66
ACD/BCF (pH 5.5): 225.06
ACD/KOC (pH 5.5): 968.04
ACD/LogD (pH 7.4): 4.49
ACD/BCF (pH 7.4): 1500.27
ACD/KOC (pH 7.4): 6452.95
Polar Surface Area: 66 Å2
Polarizability: 60.9±0.5 10-24cm3
Surface Tension: 55.5±3.0 dyne/cm
Molar Volume: 428.4±3.0 cm3

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