Found 13 results

Search term: XXSMGPRMXLTPCZ (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 2-[{(4R)-4-[(7-Chloro-4-quinolinyl)amino]pentyl}(ethyl)amino](~2~H_4_)ethanol | C18H22D4ClN3O

2-[{(4R)-4-[(7-Chloro-4-quinolinyl)amino]pentyl}(ethyl)amino](2H4)ethanol

  • Molecular FormulaC18H22D4ClN3O
  • Average mass339.896 Da
  • Monoisotopic mass339.201538 Da
  • ChemSpider ID58784162

  • defined stereocentres - 1 of 1 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

2-[{(4R)-4-[(7-Chlor-4-chinolinyl)amino]pentyl}(ethyl)amino](2H4)ethanol [German] [ACD/IUPAC Name]
2-[{(4R)-4-[(7-Chloro-4-quinoléinyl)amino]pentyl}(éthyl)amino](2H4)éthanol [French] [ACD/IUPAC Name]
2-[{(4R)-4-[(7-Chloro-4-quinolinyl)amino]pentyl}(ethyl)amino](2H4)ethanol [ACD/IUPAC Name]
Ethan-1,1,2,2-d4-ol, 2-[[(4R)-4-[(7-chloro-4-quinolinyl)amino]pentyl]ethylamino]- [ACD/Index 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: 516.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.0±3.0 kJ/mol
Flash Point: 266.3±30.1 °C
Index of Refraction: 1.610
Molar Refractivity: 99.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.77
ACD/LogD (pH 5.5): -0.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.96
ACD/BCF (pH 7.4): 7.73
ACD/KOC (pH 7.4): 54.85
Polar Surface Area: 48 Å2
Polarizability: 39.2±0.5 10-24cm3
Surface Tension: 49.8±3.0 dyne/cm
Molar Volume: 285.4±3.0 cm3

Click to predict properties on the Chemicalize site


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