ChemSpider 2D Image | N-(1,3-Benzodioxol-5-ylmethyl)-3-(3-methyl-1H-pyrazol-1-yl)-N-{[2-(4-morpholinyl)-7,8-dihydro-6H-cyclopenta[g]quinolin-3-yl]methyl}propanamide | C32H35N5O4

N-(1,3-Benzodioxol-5-ylmethyl)-3-(3-methyl-1H-pyrazol-1-yl)-N-{[2-(4-morpholinyl)-7,8-dihydro-6H-cyclopenta[g]quinolin-3-yl]methyl}propanamide

  • Molecular FormulaC32H35N5O4
  • Average mass553.651 Da
  • Monoisotopic mass553.268921 Da
  • ChemSpider ID22127114

More details:

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

1H-Pyrazole-1-propanamide, N-(1,3-benzodioxol-5-ylmethyl)-N-[[7,8-dihydro-2-(4-morpholinyl)-6H-cyclopenta[g]quinolin-3-yl]methyl]-3-methyl- [ACD/Index Name]
N-(1,3-Benzodioxol-5-ylmethyl)-3-(3-methyl-1H-pyrazol-1-yl)-N-{[2-(4-morpholinyl)-7,8-dihydro-6H-cyclopenta[g]chinolin-3-yl]methyl}propanamid [German] [ACD/IUPAC Name]
N-(1,3-Benzodioxol-5-ylméthyl)-3-(3-méthyl-1H-pyrazol-1-yl)-N-{[2-(4-morpholinyl)-7,8-dihydro-6H-cyclopenta[g]quinoléin-3-yl]méthyl}propanamide [French] [ACD/IUPAC Name]
N-(1,3-Benzodioxol-5-ylmethyl)-3-(3-methyl-1H-pyrazol-1-yl)-N-{[2-(4-morpholinyl)-7,8-dihydro-6H-cyclopenta[g]quinolin-3-yl]methyl}propanamide [ACD/IUPAC 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: 789.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 114.8±3.0 kJ/mol
Flash Point: 431.2±32.9 °C
Index of Refraction: 1.691
Molar Refractivity: 155.0±0.5 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 4.08
ACD/LogD (pH 5.5): 4.39
ACD/BCF (pH 5.5): 1248.06
ACD/KOC (pH 5.5): 5565.59
ACD/LogD (pH 7.4): 4.43
ACD/BCF (pH 7.4): 1377.84
ACD/KOC (pH 7.4): 6144.31
Polar Surface Area: 82 Å2
Polarizability: 61.4±0.5 10-24cm3
Surface Tension: 55.2±7.0 dyne/cm
Molar Volume: 404.9±7.0 cm3

Click to predict properties on the Chemicalize site


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