ChemSpider 2D Image | N-Cycloheptyl-2-(2,5-dimethoxybenzyl)-6,9-dimethoxy-1-oxo-3-phenyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide | C36H41N3O6

N-Cycloheptyl-2-(2,5-dimethoxybenzyl)-6,9-dimethoxy-1-oxo-3-phenyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide

  • Molecular FormulaC36H41N3O6
  • Average mass611.727 Da
  • Monoisotopic mass611.299561 Da
  • ChemSpider ID21922769

More details:

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

N-Cycloheptyl-2-(2,5-dimethoxybenzyl)-6,9-dimethoxy-1-oxo-3-phenyl-1,2,3,4-tetrahydropyrazino[1,2-a]indol-3-carboxamid [German] [ACD/IUPAC Name]
N-Cycloheptyl-2-(2,5-dimethoxybenzyl)-6,9-dimethoxy-1-oxo-3-phenyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide [ACD/IUPAC Name]
N-Cycloheptyl-2-(2,5-diméthoxybenzyl)-6,9-diméthoxy-1-oxo-3-phényl-1,2,3,4-tétrahydropyrazino[1,2-a]indole-3-carboxamide [French] [ACD/IUPAC Name]
Pyrazino[1,2-a]indole-3-carboxamide, N-cycloheptyl-2-[(2,5-dimethoxyphenyl)methyl]-1,2,3,4-tetrahydro-6,9-dimethoxy-1-oxo-3-phenyl- [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: 847.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 123.1±3.0 kJ/mol
Flash Point: 466.2±34.3 °C
Index of Refraction: 1.618
Molar Refractivity: 171.2±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 5.55
ACD/LogD (pH 5.5): 5.44
ACD/BCF (pH 5.5): 8022.31
ACD/KOC (pH 5.5): 21691.42
ACD/LogD (pH 7.4): 5.44
ACD/BCF (pH 7.4): 8022.31
ACD/KOC (pH 7.4): 21691.42
Polar Surface Area: 91 Å2
Polarizability: 67.9±0.5 10-24cm3
Surface Tension: 46.6±7.0 dyne/cm
Molar Volume: 488.5±7.0 cm3

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