ChemSpider 2D Image | N-[(R)-(6-Bromo-2-methoxy-3-quinolinyl)(phenyl)methyl]-N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-(1-piperazinyl)acetamide | C32H35BrN4O3

N-[(R)-(6-Bromo-2-methoxy-3-quinolinyl)(phenyl)methyl]-N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-(1-piperazinyl)acetamide

  • Molecular FormulaC32H35BrN4O3
  • Average mass603.549 Da
  • Monoisotopic mass602.189270 Da
  • ChemSpider ID30657171

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1-Piperazineacetamide, N-[(R)-(6-bromo-2-methoxy-3-quinolinyl)phenylmethyl]-N-[(1S)-1-(4-methoxyphenyl)ethyl]- [ACD/Index Name]
N-[(R)-(6-Brom-2-methoxy-3-chinolinyl)(phenyl)methyl]-N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-(1-piperazinyl)acetamid [German] [ACD/IUPAC Name]
N-[(R)-(6-Bromo-2-méthoxy-3-quinoléinyl)(phényl)méthyl]-N-[(1S)-1-(4-méthoxyphényl)éthyl]-2-(1-pipérazinyl)acétamide [French] [ACD/IUPAC Name]
N-[(R)-(6-Bromo-2-methoxy-3-quinolinyl)(phenyl)methyl]-N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-(1-piperazinyl)acetamide [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 745.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 108.6±3.0 kJ/mol
Flash Point: 404.4±32.9 °C
Index of Refraction: 1.621
Molar Refractivity: 162.7±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 5.06
ACD/LogD (pH 5.5): 2.17
ACD/BCF (pH 5.5): 5.22
ACD/KOC (pH 5.5): 16.70
ACD/LogD (pH 7.4): 3.58
ACD/BCF (pH 7.4): 134.07
ACD/KOC (pH 7.4): 428.74
Polar Surface Area: 67 Å2
Polarizability: 64.5±0.5 10-24cm3
Surface Tension: 50.5±3.0 dyne/cm
Molar Volume: 462.5±3.0 cm3

Click to predict properties on the Chemicalize site


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