ChemSpider 2D Image | 1-(3-{(1R)-1-[2-(4-Methylphenyl)-1H-indol-3-yl]-3-oxo-1,3-dihydro-2H-isoindol-2-yl}propanoyl)-4-piperidinecarboxamide | C32H32N4O3

1-(3-{(1R)-1-[2-(4-Methylphenyl)-1H-indol-3-yl]-3-oxo-1,3-dihydro-2H-isoindol-2-yl}propanoyl)-4-piperidinecarboxamide

  • Molecular FormulaC32H32N4O3
  • Average mass520.622 Da
  • Monoisotopic mass520.247437 Da
  • ChemSpider ID62298012

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1-(3-{(1R)-1-[2-(4-Methylphenyl)-1H-indol-3-yl]-3-oxo-1,3-dihydro-2H-isoindol-2-yl}propanoyl)-4-piperidincarboxamid [German] [ACD/IUPAC Name]
1-(3-{(1R)-1-[2-(4-Methylphenyl)-1H-indol-3-yl]-3-oxo-1,3-dihydro-2H-isoindol-2-yl}propanoyl)-4-piperidinecarboxamide [ACD/IUPAC Name]
1-(3-{(1R)-1-[2-(4-Méthylphényl)-1H-indol-3-yl]-3-oxo-1,3-dihydro-2H-isoindol-2-yl}propanoyl)-4-pipéridinecarboxamide [French] [ACD/IUPAC Name]
4-Piperidinecarboxamide, 1-[3-[(1R)-1,3-dihydro-1-[2-(4-methylphenyl)-1H-indol-3-yl]-3-oxo-2H-isoindol-2-yl]-1-oxopropyl]- [ACD/Index 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: 822.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 119.6±3.0 kJ/mol
Flash Point: 451.5±34.3 °C
Index of Refraction: 1.666
Molar Refractivity: 150.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 3.50
ACD/LogD (pH 5.5): 3.89
ACD/BCF (pH 5.5): 531.75
ACD/KOC (pH 5.5): 3109.31
ACD/LogD (pH 7.4): 3.89
ACD/BCF (pH 7.4): 531.75
ACD/KOC (pH 7.4): 3109.31
Polar Surface Area: 100 Å2
Polarizability: 59.6±0.5 10-24cm3
Surface Tension: 60.8±3.0 dyne/cm
Molar Volume: 404.0±3.0 cm3

Click to predict properties on the Chemicalize site


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