ChemSpider 2D Image | N-(2-{4-[6-(2,4-Dimethoxyphenyl)-3-pyridazinyl]-1-piperazinyl}-2-oxoethyl)-4-methoxy-N-(3-methylbutyl)benzamide | C31H39N5O5

N-(2-{4-[6-(2,4-Dimethoxyphenyl)-3-pyridazinyl]-1-piperazinyl}-2-oxoethyl)-4-methoxy-N-(3-methylbutyl)benzamide

  • Molecular FormulaC31H39N5O5
  • Average mass561.672 Da
  • Monoisotopic mass561.295105 Da
  • ChemSpider ID22655039

More details:






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

Benzamide, N-[2-[4-[6-(2,4-dimethoxyphenyl)-3-pyridazinyl]-1-piperazinyl]-2-oxoethyl]-4-methoxy-N-(3-methylbutyl)- [ACD/Index Name]
N-(2-{4-[6-(2,4-Dimethoxyphenyl)-3-pyridazinyl]-1-piperazinyl}-2-oxoethyl)-4-methoxy-N-(3-methylbutyl)benzamid [German] [ACD/IUPAC Name]
N-(2-{4-[6-(2,4-Dimethoxyphenyl)-3-pyridazinyl]-1-piperazinyl}-2-oxoethyl)-4-methoxy-N-(3-methylbutyl)benzamide [ACD/IUPAC Name]
N-(2-{4-[6-(2,4-Diméthoxyphényl)-3-pyridazinyl]-1-pipérazinyl}-2-oxoéthyl)-4-méthoxy-N-(3-méthylbutyl)benzamide [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 784.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 114.2±3.0 kJ/mol
Flash Point: 428.4±32.9 °C
Index of Refraction: 1.575
Molar Refractivity: 156.5±0.3 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 2.98
ACD/LogD (pH 5.5): 3.50
ACD/BCF (pH 5.5): 239.31
ACD/KOC (pH 5.5): 1517.00
ACD/LogD (pH 7.4): 3.72
ACD/BCF (pH 7.4): 396.88
ACD/KOC (pH 7.4): 2515.85
Polar Surface Area: 97 Å2
Polarizability: 62.0±0.5 10-24cm3
Surface Tension: 49.2±3.0 dyne/cm
Molar Volume: 473.8±3.0 cm3

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