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Search term: TUZBEGQKTWHIIP-OAHLLOKOSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | (4R)-6-Chloro-N-(4-isoquinolinyl)-1,2,3,4-tetrahydro-4-quinolinecarboxamide | C19H16ClN3O

(4R)-6-Chloro-N-(4-isoquinolinyl)-1,2,3,4-tetrahydro-4-quinolinecarboxamide

  • Molecular FormulaC19H16ClN3O
  • Average mass337.803 Da
  • Monoisotopic mass337.098175 Da
  • ChemSpider ID114933308

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(4R)-6-Chlor-N-(4-isochinolinyl)-1,2,3,4-tetrahydro-4-chinolincarboxamid [German] [ACD/IUPAC Name]
(4R)-6-Chloro-N-(4-isoquinoléinyl)-1,2,3,4-tétrahydro-4-quinoléinecarboxamide [French] [ACD/IUPAC Name]
(4R)-6-Chloro-N-(4-isoquinolinyl)-1,2,3,4-tetrahydro-4-quinolinecarboxamide [ACD/IUPAC Name]
4-Quinolinecarboxamide, 6-chloro-1,2,3,4-tetrahydro-N-4-isoquinolinyl-, (4R)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 599.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.3±3.0 kJ/mol
Flash Point: 316.5±30.1 °C
Index of Refraction: 1.697
Molar Refractivity: 96.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.64
ACD/LogD (pH 5.5): 3.62
ACD/BCF (pH 5.5): 319.82
ACD/KOC (pH 5.5): 2081.05
ACD/LogD (pH 7.4): 3.67
ACD/BCF (pH 7.4): 364.41
ACD/KOC (pH 7.4): 2371.18
Polar Surface Area: 54 Å2
Polarizability: 38.2±0.5 10-24cm3
Surface Tension: 62.6±3.0 dyne/cm
Molar Volume: 250.2±3.0 cm3

Click to predict properties on the Chemicalize site


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