ChemSpider 2D Image | N-{1-[3-(4-Fluorophenyl)-4-methyl-1-piperazinyl]-3-(4-hydroxyphenyl)-1-oxo-2-propanyl}-4,5-dimethoxy-2-nitrobenzamide | C29H31FN4O7

N-{1-[3-(4-Fluorophenyl)-4-methyl-1-piperazinyl]-3-(4-hydroxyphenyl)-1-oxo-2-propanyl}-4,5-dimethoxy-2-nitrobenzamide

  • Molecular FormulaC29H31FN4O7
  • Average mass566.577 Da
  • Monoisotopic mass566.217651 Da
  • ChemSpider ID122297678

More details:

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

Benzamide, N-[2-[3-(4-fluorophenyl)-4-methyl-1-piperazinyl]-1-[(4-hydroxyphenyl)methyl]-2-oxoethyl]-4,5-dimethoxy-2-nitro- [ACD/Index Name]
N-{1-[3-(4-Fluorophenyl)-4-methyl-1-piperazinyl]-3-(4-hydroxyphenyl)-1-oxo-2-propanyl}-4,5-dimethoxy-2-nitrobenzamide [ACD/IUPAC Name]
N-{1-[3-(4-Fluorophényl)-4-méthyl-1-pipérazinyl]-3-(4-hydroxyphényl)-1-oxo-2-propanyl}-4,5-diméthoxy-2-nitrobenzamide [French] [ACD/IUPAC Name]
N-{1-[3-(4-Fluorphenyl)-4-methyl-1-piperazinyl]-3-(4-hydroxyphenyl)-1-oxo-2-propanyl}-4,5-dimethoxy-2-nitrobenzamid [German] [ACD/IUPAC 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: 756.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 114.1±3.0 kJ/mol
Flash Point: 411.3±32.9 °C
Index of Refraction: 1.607
Molar Refractivity: 148.0±0.3 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 3.96
ACD/LogD (pH 5.5): 2.40
ACD/BCF (pH 5.5): 29.04
ACD/KOC (pH 5.5): 270.01
ACD/LogD (pH 7.4): 2.94
ACD/BCF (pH 7.4): 100.33
ACD/KOC (pH 7.4): 932.92
Polar Surface Area: 137 Å2
Polarizability: 58.7±0.5 10-24cm3
Surface Tension: 54.8±3.0 dyne/cm
Molar Volume: 428.8±3.0 cm3

Click to predict properties on the Chemicalize site


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