ChemSpider 2D Image | 1-(1H-Indol-3-yl)-3-{[5-(6-isoquinolinyl)-3-pyridinyl]oxy}-2-propanamine | C25H22N4O

1-(1H-Indol-3-yl)-3-{[5-(6-isoquinolinyl)-3-pyridinyl]oxy}-2-propanamine

  • Molecular FormulaC25H22N4O
  • Average mass394.468 Da
  • Monoisotopic mass394.179352 Da
  • ChemSpider ID11496540

More details:

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

1-(1H-Indol-3-yl)-3-{[5-(6-isochinolinyl)-3-pyridinyl]oxy}-2-propanamin [German] [ACD/IUPAC Name]
1-(1H-Indol-3-yl)-3-{[5-(6-isoquinoléinyl)-3-pyridinyl]oxy}-2-propanamine [French] [ACD/IUPAC Name]
1-(1H-Indol-3-yl)-3-{[5-(6-isoquinolinyl)-3-pyridinyl]oxy}-2-propanamine [ACD/IUPAC Name]
1H-Indole-3-ethanamine, α-[[[5-(6-isoquinolinyl)-3-pyridinyl]oxy]methyl]- [ACD/Index Name]
Kinome_876

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

Density: 1.3±0.1 g/cm3
Boiling Point: 688.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.9±3.0 kJ/mol
Flash Point: 370.1±31.5 °C
Index of Refraction: 1.711
Molar Refractivity: 121.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.33
ACD/LogD (pH 5.5): 0.64
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.30
ACD/LogD (pH 7.4): 2.04
ACD/BCF (pH 7.4): 8.73
ACD/KOC (pH 7.4): 58.26
Polar Surface Area: 77 Å2
Polarizability: 48.0±0.5 10-24cm3
Surface Tension: 62.7±3.0 dyne/cm
Molar Volume: 309.5±3.0 cm3

Click to predict properties on the Chemicalize site


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