ChemSpider 2D Image | 4-(4-{[4-(2,4-Dimethylphenyl)-1-piperazinyl]carbonyl}-1-piperidinyl)-2-[2-(2-methoxyphenyl)ethyl]-1H-isoindole-1,3(2H)-dione | C35H40N4O4

4-(4-{[4-(2,4-Dimethylphenyl)-1-piperazinyl]carbonyl}-1-piperidinyl)-2-[2-(2-methoxyphenyl)ethyl]-1H-isoindole-1,3(2H)-dione

  • Molecular FormulaC35H40N4O4
  • Average mass580.716 Da
  • Monoisotopic mass580.304932 Da
  • ChemSpider ID22240228

More details:

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

1H-Isoindole-1,3(2H)-dione, 4-[4-[[4-(2,4-dimethylphenyl)-1-piperazinyl]carbonyl]-1-piperidinyl]-2-[2-(2-methoxyphenyl)ethyl]- [ACD/Index Name]
4-(4-{[4-(2,4-Dimethylphenyl)-1-piperazinyl]carbonyl}-1-piperidinyl)-2-[2-(2-methoxyphenyl)ethyl]-1H-isoindol-1,3(2H)-dion [German] [ACD/IUPAC Name]
4-(4-{[4-(2,4-Dimethylphenyl)-1-piperazinyl]carbonyl}-1-piperidinyl)-2-[2-(2-methoxyphenyl)ethyl]-1H-isoindole-1,3(2H)-dione [ACD/IUPAC Name]
4-(4-{[4-(2,4-Diméthylphényl)-1-pipérazinyl]carbonyl}-1-pipéridinyl)-2-[2-(2-méthoxyphényl)éthyl]-1H-isoindole-1,3(2H)-dione [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 781.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 113.7±3.0 kJ/mol
Flash Point: 426.3±32.9 °C
Index of Refraction: 1.621
Molar Refractivity: 165.2±0.3 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 5.33
ACD/LogD (pH 5.5): 5.08
ACD/BCF (pH 5.5): 4275.23
ACD/KOC (pH 5.5): 13739.39
ACD/LogD (pH 7.4): 5.09
ACD/BCF (pH 7.4): 4367.39
ACD/KOC (pH 7.4): 14035.59
Polar Surface Area: 73 Å2
Polarizability: 65.5±0.5 10-24cm3
Surface Tension: 54.1±3.0 dyne/cm
Molar Volume: 469.7±3.0 cm3

Click to predict properties on the Chemicalize site


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