ChemSpider 2D Image | 5-Ethyl-3-{[4-(4-methoxyphenyl)-1-piperazinyl]carbonyl}-5,5a,6,7,8,9-hexahydro-11H-pyrido[2,1-b]quinazolin-11-one | C26H32N4O3

5-Ethyl-3-{[4-(4-methoxyphenyl)-1-piperazinyl]carbonyl}-5,5a,6,7,8,9-hexahydro-11H-pyrido[2,1-b]quinazolin-11-one

  • Molecular FormulaC26H32N4O3
  • Average mass448.557 Da
  • Monoisotopic mass448.247437 Da
  • ChemSpider ID34268441

More details:

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

11H-Pyrido[2,1-b]quinazolin-11-one, 5-ethyl-5,5a,6,7,8,9-hexahydro-3-[[4-(4-methoxyphenyl)-1-piperazinyl]carbonyl]- [ACD/Index Name]
5-Ethyl-3-{[4-(4-methoxyphenyl)-1-piperazinyl]carbonyl}-5,5a,6,7,8,9-hexahydro-11H-pyrido[2,1-b]chinazolin-11-on [German] [ACD/IUPAC Name]
5-Ethyl-3-{[4-(4-methoxyphenyl)-1-piperazinyl]carbonyl}-5,5a,6,7,8,9-hexahydro-11H-pyrido[2,1-b]quinazolin-11-one [ACD/IUPAC Name]
5-Éthyl-3-{[4-(4-méthoxyphényl)-1-pipérazinyl]carbonyl}-5,5a,6,7,8,9-hexahydro-11H-pyrido[2,1-b]quinazolin-11-one [French] [ACD/IUPAC Name]
[1574585-28-6] [RN]
1574585-28-6 [RN]
5-ethyl-3-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-5H,5aH,6H,7H,8H,9H,11H-pyrido[2,1-b]quinazolin-11-one
5-ethyl-3-{[4-(4-methoxyphenyl)piperazin-1-yl]carbonyl}-5,5a,6,7,8,9-hexahydro-11H-pyrido[2,1-b]quinazolin-11-one
5-ethyl-3-{[4-(4-methoxyphenyl)piperazino]carbonyl}-5,5a,6,7,8,9-hexahydro-11H-pyrido[2,1-b]quinazolin-11-one
BS-8736
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 688.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.9±3.0 kJ/mol
Flash Point: 370.1±31.5 °C
Index of Refraction: 1.659
Molar Refractivity: 127.6±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.44
ACD/LogD (pH 5.5): 1.96
ACD/BCF (pH 5.5): 18.15
ACD/KOC (pH 5.5): 276.51
ACD/LogD (pH 7.4): 1.96
ACD/BCF (pH 7.4): 18.31
ACD/KOC (pH 7.4): 278.83
Polar Surface Area: 56 Å2
Polarizability: 50.6±0.5 10-24cm3
Surface Tension: 63.8±5.0 dyne/cm
Molar Volume: 346.2±5.0 cm3

Click to predict properties on the Chemicalize site


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