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ChemSpider 2D Image | N-(2,3-Dihydro-1,4-benzodioxin-2-ylmethyl)-N-{[5,8-dimethoxy-2-(4-morpholinyl)-3-quinolinyl]methyl}-2-(3-thienyl)acetamide | C31H33N3O6S


  • Molecular FormulaC31H33N3O6S
  • Average mass575.675 Da
  • Monoisotopic mass575.208984 Da
  • ChemSpider ID22124267

More details:

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

3-Thiopheneacetamide, N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-N-[[5,8-dimethoxy-2-(4-morpholinyl)-3-quinolinyl]methyl]- [ACD/Index Name]
N-(2,3-Dihydro-1,4-benzodioxin-2-ylmethyl)-N-{[5,8-dimethoxy-2-(4-morpholinyl)-3-chinolinyl]methyl}-2-(3-thienyl)acetamid [German] [ACD/IUPAC Name]
N-(2,3-Dihydro-1,4-benzodioxin-2-ylméthyl)-N-{[5,8-diméthoxy-2-(4-morpholinyl)-3-quinoléinyl]méthyl}-2-(3-thiényl)acétamide [French] [ACD/IUPAC Name]
N-(2,3-Dihydro-1,4-benzodioxin-2-ylmethyl)-N-{[5,8-dimethoxy-2-(4-morpholinyl)-3-quinolinyl]methyl}-2-(3-thienyl)acetamide [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 783.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 114.0±3.0 kJ/mol
Flash Point: 427.5±32.9 °C
Index of Refraction: 1.631
Molar Refractivity: 157.8±0.3 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 3.89
ACD/LogD (pH 5.5): 4.23
ACD/BCF (pH 5.5): 960.58
ACD/KOC (pH 5.5): 4729.87
ACD/LogD (pH 7.4): 4.24
ACD/BCF (pH 7.4): 973.33
ACD/KOC (pH 7.4): 4792.67
Polar Surface Area: 111 Å2
Polarizability: 62.6±0.5 10-24cm3
Surface Tension: 55.5±3.0 dyne/cm
Molar Volume: 442.8±3.0 cm3

Click to predict properties on the Chemicalize site