ChemSpider 2D Image | 1-{1-[(4-Cyclohexyl-1-piperazinyl)carbonyl]-6-azaspiro[2.5]oct-6-yl}-2-(3,4-dimethoxyphenyl)ethanone | C28H41N3O4

1-{1-[(4-Cyclohexyl-1-piperazinyl)carbonyl]-6-azaspiro[2.5]oct-6-yl}-2-(3,4-dimethoxyphenyl)ethanone

  • Molecular FormulaC28H41N3O4
  • Average mass483.643 Da
  • Monoisotopic mass483.309692 Da
  • ChemSpider ID22147792

More details:

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

1-{1-[(4-Cyclohexyl-1-piperazinyl)carbonyl]-6-azaspiro[2.5]oct-6-yl}-2-(3,4-dimethoxyphenyl)ethanon [German] [ACD/IUPAC Name]
1-{1-[(4-Cyclohexyl-1-piperazinyl)carbonyl]-6-azaspiro[2.5]oct-6-yl}-2-(3,4-dimethoxyphenyl)ethanone [ACD/IUPAC Name]
1-{1-[(4-Cyclohexyl-1-pipérazinyl)carbonyl]-6-azaspiro[2.5]oct-6-yl}-2-(3,4-diméthoxyphényl)éthanone [French] [ACD/IUPAC Name]
Ethanone, 1-[1-[(4-cyclohexyl-1-piperazinyl)carbonyl]-6-azaspiro[2.5]oct-6-yl]-2-(3,4-dimethoxyphenyl)- [ACD/Index Name]
1-[(4-cyclohexyl-1-piperazinyl)carbonyl]-6-[(3,4-dimethoxyphenyl)acetyl]-6-azaspiro[2.5]octane

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

Density: 1.2±0.1 g/cm3
Boiling Point: 672.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 98.8±3.0 kJ/mol
Flash Point: 360.6±31.5 °C
Index of Refraction: 1.596
Molar Refractivity: 135.8±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.25
ACD/LogD (pH 5.5): 1.83
ACD/BCF (pH 5.5): 7.35
ACD/KOC (pH 5.5): 65.60
ACD/LogD (pH 7.4): 2.96
ACD/BCF (pH 7.4): 100.59
ACD/KOC (pH 7.4): 897.41
Polar Surface Area: 62 Å2
Polarizability: 53.8±0.5 10-24cm3
Surface Tension: 54.9±5.0 dyne/cm
Molar Volume: 399.0±5.0 cm3

Click to predict properties on the Chemicalize site


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