ChemSpider 2D Image | 13-[(4-Cyclohexyl-1-piperazinyl)carbonyl]-10,11-dimethoxy-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one | C30H37N3O4

13-[(4-Cyclohexyl-1-piperazinyl)carbonyl]-10,11-dimethoxy-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one

  • Molecular FormulaC30H37N3O4
  • Average mass503.633 Da
  • Monoisotopic mass503.278412 Da
  • ChemSpider ID3882450

More details:

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

13-[(4-Cyclohexyl-1-piperazinyl)carbonyl]-10,11-dimethoxy-5,6,13,13a-tetrahydro-8H-isochinolino[3,2-a]isochinolin-8-on [German] [ACD/IUPAC Name]
13-[(4-Cyclohexyl-1-pipérazinyl)carbonyl]-10,11-diméthoxy-5,6,13,13a-tétrahydro-8H-isoquinoléino[3,2-a]isoquinoléin-8-one [French] [ACD/IUPAC Name]
13-[(4-Cyclohexyl-1-piperazinyl)carbonyl]-10,11-dimethoxy-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one [ACD/IUPAC Name]
8H-Dibenzo[a,g]quinolizin-8-one, 13-[(4-cyclohexyl-1-piperazinyl)carbonyl]-5,6,13,13a-tetrahydro-10,11-dimethoxy- [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: 696.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.9±3.0 kJ/mol
Flash Point: 374.8±31.5 °C
Index of Refraction: 1.643
Molar Refractivity: 141.9±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 4.93
ACD/LogD (pH 5.5): 3.47
ACD/BCF (pH 5.5): 144.89
ACD/KOC (pH 5.5): 624.90
ACD/LogD (pH 7.4): 4.45
ACD/BCF (pH 7.4): 1381.43
ACD/KOC (pH 7.4): 5958.12
Polar Surface Area: 62 Å2
Polarizability: 56.3±0.5 10-24cm3
Surface Tension: 61.3±5.0 dyne/cm
Molar Volume: 392.3±5.0 cm3

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