ChemSpider 2D Image | 2-({3-[(3,5-Dibromo-2-ethoxybenzyl)amino]propyl}amino)-4-quinolinol | C21H23Br2N3O2

2-({3-[(3,5-Dibromo-2-ethoxybenzyl)amino]propyl}amino)-4-quinolinol

  • Molecular FormulaC21H23Br2N3O2
  • Average mass509.234 Da
  • Monoisotopic mass507.015686 Da
  • ChemSpider ID23230276

More details:

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

2-({3-[(3,5-Dibrom-2-ethoxybenzyl)amino]propyl}amino)-4-chinolinol [German] [ACD/IUPAC Name]
2-({3-[(3,5-Dibromo-2-éthoxybenzyl)amino]propyl}amino)-4-quinoléinol [French] [ACD/IUPAC Name]
2-({3-[(3,5-Dibromo-2-ethoxybenzyl)amino]propyl}amino)-4-quinolinol [ACD/IUPAC Name]
2-({3-[(3,5-Dibromo-2-Ethoxybenzyl)amino]propyl}amino)quinolin-4(1h)-One
2-({3-[(3,5-dibromo-2-ethoxybenzyl)amino]propyl}amino)quinolin-4-ol
4-Quinolinol, 2-[[3-[[(3,5-dibromo-2-ethoxyphenyl)methyl]amino]propyl]amino]- [ACD/Index Name]
0OT
2-[3-(3,5-Dibromo-2-ethoxy-benzylamino)-propylamino]-1H-quinolin-4-one
CHEMBL160506

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

Density: 1.6±0.1 g/cm3
Boiling Point: 646.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.8±3.0 kJ/mol
Flash Point: 344.6±31.5 °C
Index of Refraction: 1.673
Molar Refractivity: 122.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 5.99
ACD/LogD (pH 5.5): 2.12
ACD/BCF (pH 5.5): 3.44
ACD/KOC (pH 5.5): 8.48
ACD/LogD (pH 7.4): 2.76
ACD/BCF (pH 7.4): 14.93
ACD/KOC (pH 7.4): 36.79
Polar Surface Area: 66 Å2
Polarizability: 48.5±0.5 10-24cm3
Surface Tension: 56.7±3.0 dyne/cm
Molar Volume: 326.6±3.0 cm3

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