ChemSpider 2D Image | 10,11-Dimethoxy-N-{[1-(3-methylbenzyl)-4-piperidinyl]methyl}-8-oxo-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinoline-13-carboxamide | C34H39N3O4

10,11-Dimethoxy-N-{[1-(3-methylbenzyl)-4-piperidinyl]methyl}-8-oxo-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinoline-13-carboxamide

  • Molecular FormulaC34H39N3O4
  • Average mass553.691 Da
  • Monoisotopic mass553.294067 Da
  • ChemSpider ID13131061

More details:

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

10,11-Dimethoxy-N-{[1-(3-methylbenzyl)-4-piperidinyl]methyl}-8-oxo-5,8,13,13a-tetrahydro-6H-isochinolino[3,2-a]isochinolin-13-carboxamid [German] [ACD/IUPAC Name]
10,11-Diméthoxy-N-{[1-(3-méthylbenzyl)-4-pipéridinyl]méthyl}-8-oxo-5,8,13,13a-tétrahydro-6H-isoquinoléino[3,2-a]isoquinoléine-13-carboxamide [French] [ACD/IUPAC Name]
10,11-Dimethoxy-N-{[1-(3-methylbenzyl)-4-piperidinyl]methyl}-8-oxo-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinoline-13-carboxamide [ACD/IUPAC Name]
6H-Dibenzo[a,g]quinolizine-13-carboxamide, 5,8,13,13a-tetrahydro-10,11-dimethoxy-N-[[1-[(3-methylphenyl)methyl]-4-piperidinyl]methyl]-8-oxo- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 754.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 109.9±3.0 kJ/mol
Flash Point: 410.1±32.9 °C
Index of Refraction: 1.647
Molar Refractivity: 159.2±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 4.96
ACD/LogD (pH 5.5): 2.12
ACD/BCF (pH 5.5): 5.00
ACD/KOC (pH 5.5): 17.19
ACD/LogD (pH 7.4): 3.66
ACD/BCF (pH 7.4): 173.41
ACD/KOC (pH 7.4): 595.65
Polar Surface Area: 71 Å2
Polarizability: 63.1±0.5 10-24cm3
Surface Tension: 60.4±5.0 dyne/cm
Molar Volume: 437.8±5.0 cm3

Click to predict properties on the Chemicalize site


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