ChemSpider 2D Image | 5-(3-Isopropylphenoxy)-2-(4-methoxyphenyl)-4-({4-[(4-methyl-1-piperazinyl)carbonyl]phenyl}amino)-3(2H)-pyridazinone | C32H35N5O4

5-(3-Isopropylphenoxy)-2-(4-methoxyphenyl)-4-({4-[(4-methyl-1-piperazinyl)carbonyl]phenyl}amino)-3(2H)-pyridazinone

  • Molecular FormulaC32H35N5O4
  • Average mass553.651 Da
  • Monoisotopic mass553.268921 Da
  • ChemSpider ID21556422

More details:

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

3(2H)-Pyridazinone, 2-(4-methoxyphenyl)-5-[3-(1-methylethyl)phenoxy]-4-[[4-[(4-methyl-1-piperazinyl)carbonyl]phenyl]amino]- [ACD/Index Name]
5-(3-Isopropylphenoxy)-2-(4-methoxyphenyl)-4-({4-[(4-methyl-1-piperazinyl)carbonyl]phenyl}amino)-3(2H)-pyridazinon [German] [ACD/IUPAC Name]
5-(3-Isopropylphenoxy)-2-(4-methoxyphenyl)-4-({4-[(4-methyl-1-piperazinyl)carbonyl]phenyl}amino)-3(2H)-pyridazinone [ACD/IUPAC Name]
5-(3-Isopropylphénoxy)-2-(4-méthoxyphényl)-4-({4-[(4-méthyl-1-pipérazinyl)carbonyl]phényl}amino)-3(2H)-pyridazinone [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 682.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.1±3.0 kJ/mol
Flash Point: 366.7±34.3 °C
Index of Refraction: 1.624
Molar Refractivity: 159.0±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 3.91
ACD/LogD (pH 5.5): 2.35
ACD/BCF (pH 5.5): 17.52
ACD/KOC (pH 5.5): 115.77
ACD/LogD (pH 7.4): 3.55
ACD/BCF (pH 7.4): 278.92
ACD/KOC (pH 7.4): 1843.29
Polar Surface Area: 87 Å2
Polarizability: 63.0±0.5 10-24cm3
Surface Tension: 46.8±7.0 dyne/cm
Molar Volume: 450.1±7.0 cm3

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