ChemSpider 2D Image | N-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-[4-(3,4-dihydro-2(1H)-isoquinolinylcarbonyl)-2-oxo-1(2H)-quinolinyl]acetamide | C29H25N3O5

N-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-[4-(3,4-dihydro-2(1H)-isoquinolinylcarbonyl)-2-oxo-1(2H)-quinolinyl]acetamide

  • Molecular FormulaC29H25N3O5
  • Average mass495.526 Da
  • Monoisotopic mass495.179413 Da
  • ChemSpider ID21638403

More details:

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

1(2H)-Quinolineacetamide, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(3,4-dihydro-2(1H)-isoquinolinyl)carbonyl]-2-oxo- [ACD/Index Name]
N-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-[4-(3,4-dihydro-2(1H)-isochinolinylcarbonyl)-2-oxo-1(2H)-chinolinyl]acetamid [German] [ACD/IUPAC Name]
N-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-[4-(3,4-dihydro-2(1H)-isoquinoléinylcarbonyl)-2-oxo-1(2H)-quinoléinyl]acétamide [French] [ACD/IUPAC Name]
N-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-[4-(3,4-dihydro-2(1H)-isoquinolinylcarbonyl)-2-oxo-1(2H)-quinolinyl]acetamide [ACD/IUPAC Name]
MFCD09780190
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-(3,4-dihydroisoquinolin-2(1H)-ylcarbonyl)-2-oxoquinolin-1(2H)-yl]acetamide
N-(2,3-Dihydro-benzo[1,4]dioxin-6-yl)-2-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-oxo-2H-quinolin-1-yl]-acetamide
N-(2H,3H-benzo[3,4-e]1,4-dioxin-6-yl)-2-[2-oxo-4-(2-1,2,3,4-tetrahydroisoquinolylcarbonyl)hydroquinolyl]acetamide

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

Density: 1.4±0.1 g/cm3
Boiling Point: 765.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 111.4±3.0 kJ/mol
Flash Point: 416.5±32.9 °C
Index of Refraction: 1.684
Molar Refractivity: 135.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.58
ACD/LogD (pH 5.5): 3.11
ACD/BCF (pH 5.5): 136.01
ACD/KOC (pH 5.5): 1171.70
ACD/LogD (pH 7.4): 3.11
ACD/BCF (pH 7.4): 136.00
ACD/KOC (pH 7.4): 1171.62
Polar Surface Area: 88 Å2
Polarizability: 53.8±0.5 10-24cm3
Surface Tension: 65.8±3.0 dyne/cm
Molar Volume: 357.2±3.0 cm3

Click to predict properties on the Chemicalize site


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