ChemSpider 2D Image | 4-({6,7-Dimethoxy-1-[(2-methoxyphenoxy)methyl]-3,4-dihydro-2(1H)-isoquinolinyl}carbonyl)-N,N-diethylbenzenesulfonamide | C30H36N2O7S

4-({6,7-Dimethoxy-1-[(2-methoxyphenoxy)methyl]-3,4-dihydro-2(1H)-isoquinolinyl}carbonyl)-N,N-diethylbenzenesulfonamide

  • Molecular FormulaC30H36N2O7S
  • Average mass568.681 Da
  • Monoisotopic mass568.224304 Da
  • ChemSpider ID4232912

More details:

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

4-({6,7-Dimethoxy-1-[(2-methoxyphenoxy)methyl]-3,4-dihydro-2(1H)-isochinolinyl}carbonyl)-N,N-diethylbenzolsulfonamid [German] [ACD/IUPAC Name]
4-({6,7-Diméthoxy-1-[(2-méthoxyphénoxy)méthyl]-3,4-dihydro-2(1H)-isoquinoléinyl}carbonyl)-N,N-diéthylbenzènesulfonamide [French] [ACD/IUPAC Name]
4-({6,7-Dimethoxy-1-[(2-methoxyphenoxy)methyl]-3,4-dihydro-2(1H)-isoquinolinyl}carbonyl)-N,N-diethylbenzenesulfonamide [ACD/IUPAC Name]
Benzenesulfonamide, 4-[[3,4-dihydro-6,7-dimethoxy-1-[(2-methoxyphenoxy)methyl]-2(1H)-isoquinolinyl]carbonyl]-N,N-diethyl- [ACD/Index Name]
4-(6,7-dimethoxy-1-((2-methoxyphenoxy)methyl)-1,2,3,4-tetrahydroisoquinoline-2-carbonyl)-N,N-diethylbenzenesulfonamide
4-{[6,7-dimethoxy-1-[(2-methoxyphenoxy)methyl]-3,4-dihydroisoquinolin-2(1H)-yl]carbonyl}-N,N-diethylbenzenesulfonamide

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

Density: 1.2±0.1 g/cm3
Boiling Point: 709.4±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 103.7±3.0 kJ/mol
Flash Point: 382.8±35.7 °C
Index of Refraction: 1.574
Molar Refractivity: 153.3±0.4 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 4.26
ACD/LogD (pH 5.5): 3.92
ACD/BCF (pH 5.5): 564.68
ACD/KOC (pH 5.5): 3245.96
ACD/LogD (pH 7.4): 3.92
ACD/BCF (pH 7.4): 564.68
ACD/KOC (pH 7.4): 3245.96
Polar Surface Area: 103 Å2
Polarizability: 60.8±0.5 10-24cm3
Surface Tension: 46.2±3.0 dyne/cm
Molar Volume: 464.4±3.0 cm3

Click to predict properties on the Chemicalize site


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