ChemSpider 2D Image | N-{[5,8-Dimethoxy-2-(4-methylphenyl)-3-quinolinyl]methyl}-N-[2-(dimethylamino)ethyl]-1,3-dimethyl-1H-pyrazole-5-carboxamide | C29H35N5O3

N-{[5,8-Dimethoxy-2-(4-methylphenyl)-3-quinolinyl]methyl}-N-[2-(dimethylamino)ethyl]-1,3-dimethyl-1H-pyrazole-5-carboxamide

  • Molecular FormulaC29H35N5O3
  • Average mass501.620 Da
  • Monoisotopic mass501.273987 Da
  • ChemSpider ID22215657

More details:

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

1H-Pyrazole-5-carboxamide, N-[[5,8-dimethoxy-2-(4-methylphenyl)-3-quinolinyl]methyl]-N-[2-(dimethylamino)ethyl]-1,3-dimethyl- [ACD/Index Name]
N-{[5,8-Dimethoxy-2-(4-methylphenyl)-3-chinolinyl]methyl}-N-[2-(dimethylamino)ethyl]-1,3-dimethyl-1H-pyrazol-5-carboxamid [German] [ACD/IUPAC Name]
N-{[5,8-Diméthoxy-2-(4-méthylphényl)-3-quinoléinyl]méthyl}-N-[2-(diméthylamino)éthyl]-1,3-diméthyl-1H-pyrazole-5-carboxamide [French] [ACD/IUPAC Name]
N-{[5,8-Dimethoxy-2-(4-methylphenyl)-3-quinolinyl]methyl}-N-[2-(dimethylamino)ethyl]-1,3-dimethyl-1H-pyrazole-5-carboxamide [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: 708.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 103.6±3.0 kJ/mol
Flash Point: 382.1±32.9 °C
Index of Refraction: 1.595
Molar Refractivity: 146.3±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 3.11
ACD/LogD (pH 5.5): 1.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.96
ACD/LogD (pH 7.4): 2.77
ACD/BCF (pH 7.4): 44.36
ACD/KOC (pH 7.4): 283.53
Polar Surface Area: 73 Å2
Polarizability: 58.0±0.5 10-24cm3
Surface Tension: 40.7±7.0 dyne/cm
Molar Volume: 430.7±7.0 cm3

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