ChemSpider 2D Image | {6-Chloro-4-[(2-chloro-4-fluorobenzyl)amino]-3-quinolinyl}(4-morpholinyl)methanone | C21H18Cl2FN3O2

{6-Chloro-4-[(2-chloro-4-fluorobenzyl)amino]-3-quinolinyl}(4-morpholinyl)methanone

  • Molecular FormulaC21H18Cl2FN3O2
  • Average mass434.291 Da
  • Monoisotopic mass433.076019 Da
  • ChemSpider ID27310990

More details:

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

{6-Chlor-4-[(2-chlor-4-fluorbenzyl)amino]-3-chinolinyl}(4-morpholinyl)methanon [German] [ACD/IUPAC Name]
{6-Chloro-4-[(2-chloro-4-fluorobenzyl)amino]-3-quinoléinyl}(4-morpholinyl)méthanone [French] [ACD/IUPAC Name]
{6-Chloro-4-[(2-chloro-4-fluorobenzyl)amino]-3-quinolinyl}(4-morpholinyl)methanone [ACD/IUPAC Name]
Methanone, [6-chloro-4-[[(2-chloro-4-fluorophenyl)methyl]amino]-3-quinolinyl]-4-morpholinyl- [ACD/Index Name]
[6-Chloro-4-(2-chloro-4-fluoro-benzylamino)-quinolin-3-yl]-morpholin-4-yl-methanone
{6-chloro-4-[(2-chloro-4-fluorobenzyl)amino]quinolin-3-yl}(morpholin-4-yl)methanone
1326878-49-2 [RN]
6-chloro-N-[(2-chloro-4-fluorophenyl)methyl]-3-(morpholine-4-carbonyl)quinolin-4-amine

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

Density: 1.4±0.1 g/cm3
Boiling Point: 622.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.2±3.0 kJ/mol
Flash Point: 330.2±31.5 °C
Index of Refraction: 1.674
Molar Refractivity: 113.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.31
ACD/LogD (pH 5.5): 4.31
ACD/BCF (pH 5.5): 893.83
ACD/KOC (pH 5.5): 3461.68
ACD/LogD (pH 7.4): 4.71
ACD/BCF (pH 7.4): 2222.85
ACD/KOC (pH 7.4): 8608.77
Polar Surface Area: 54 Å2
Polarizability: 44.8±0.5 10-24cm3
Surface Tension: 63.1±3.0 dyne/cm
Molar Volume: 301.2±3.0 cm3

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