ChemSpider 2D Image | N-(1,3-Benzodioxol-5-ylmethyl)-3,4,5-trimethoxy-N-[(6-methoxy-2-oxo-1,2-dihydro-3-quinolinyl)methyl]benzamide | C29H28N2O8

N-(1,3-Benzodioxol-5-ylmethyl)-3,4,5-trimethoxy-N-[(6-methoxy-2-oxo-1,2-dihydro-3-quinolinyl)methyl]benzamide

  • Molecular FormulaC29H28N2O8
  • Average mass532.541 Da
  • Monoisotopic mass532.184570 Da
  • ChemSpider ID2445302

More details:

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

Benzamide, N-(1,3-benzodioxol-5-ylmethyl)-N-[(1,2-dihydro-6-methoxy-2-oxo-3-quinolinyl)methyl]-3,4,5-trimethoxy- [ACD/Index Name]
N-(1,3-Benzodioxol-5-ylmethyl)-3,4,5-trimethoxy-N-[(6-methoxy-2-oxo-1,2-dihydro-3-chinolinyl)methyl]benzamid [German] [ACD/IUPAC Name]
N-(1,3-Benzodioxol-5-ylméthyl)-3,4,5-triméthoxy-N-[(6-méthoxy-2-oxo-1,2-dihydro-3-quinoléinyl)méthyl]benzamide [French] [ACD/IUPAC Name]
N-(1,3-Benzodioxol-5-ylmethyl)-3,4,5-trimethoxy-N-[(6-methoxy-2-oxo-1,2-dihydro-3-quinolinyl)methyl]benzamide [ACD/IUPAC Name]

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

ASN 05107934 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 786.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 114.4±3.0 kJ/mol
Flash Point: 429.4±32.9 °C
Index of Refraction: 1.609
Molar Refractivity: 141.5±0.3 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 4.93
ACD/LogD (pH 5.5): 3.63
ACD/BCF (pH 5.5): 338.01
ACD/KOC (pH 5.5): 2248.08
ACD/LogD (pH 7.4): 3.63
ACD/BCF (pH 7.4): 337.74
ACD/KOC (pH 7.4): 2246.28
Polar Surface Area: 105 Å2
Polarizability: 56.1±0.5 10-24cm3
Surface Tension: 50.8±3.0 dyne/cm
Molar Volume: 408.7±3.0 cm3

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