ChemSpider 2D Image | N-(4-Chlorobenzyl)-4-{4-[(2-methyl-2-propanyl)amino]-1-piperidinyl}-2-quinolinamine | C25H31ClN4

N-(4-Chlorobenzyl)-4-{4-[(2-methyl-2-propanyl)amino]-1-piperidinyl}-2-quinolinamine

  • Molecular FormulaC25H31ClN4
  • Average mass422.993 Da
  • Monoisotopic mass422.223724 Da
  • ChemSpider ID115006936

More details:

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

2-Quinolinamine, N-[(4-chlorophenyl)methyl]-4-[4-[(1,1-dimethylethyl)amino]-1-piperidinyl]- [ACD/Index Name]
N-(4-Chlorbenzyl)-4-{4-[(2-methyl-2-propanyl)amino]-1-piperidinyl}-2-chinolinamin [German] [ACD/IUPAC Name]
N-(4-Chlorobenzyl)-4-{4-[(2-méthyl-2-propanyl)amino]-1-pipéridinyl}-2-quinoléinamine [French] [ACD/IUPAC Name]
N-(4-Chlorobenzyl)-4-{4-[(2-methyl-2-propanyl)amino]-1-piperidinyl}-2-quinolinamine [ACD/IUPAC Name]
1914148-72-3 [RN]
4-[4-(tert-butylamino)piperidin-1-yl]-N-[(4-chlorophenyl)methyl]quinolin-2-amine
Ezurpimtrostat

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

Density: 1.2±0.1 g/cm3
Boiling Point: 590.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.1±3.0 kJ/mol
Flash Point: 311.1±30.1 °C
Index of Refraction: 1.638
Molar Refractivity: 127.1±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.95
ACD/LogD (pH 5.5): 1.51
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.14
ACD/LogD (pH 7.4): 1.94
ACD/BCF (pH 7.4): 2.33
ACD/KOC (pH 7.4): 5.79
Polar Surface Area: 40 Å2
Polarizability: 50.4±0.5 10-24cm3
Surface Tension: 54.7±5.0 dyne/cm
Molar Volume: 353.6±5.0 cm3

Click to predict properties on the Chemicalize site


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