ChemSpider 2D Image | N-(3-{[5-Chloro-4-(4-methyl-1-piperazinyl)-6-oxo-1(6H)-pyridazinyl]methyl}-2-methylphenyl)-4-(6-methoxy-3-pyridinyl)benzamide | C30H31ClN6O3

N-(3-{[5-Chloro-4-(4-methyl-1-piperazinyl)-6-oxo-1(6H)-pyridazinyl]methyl}-2-methylphenyl)-4-(6-methoxy-3-pyridinyl)benzamide

  • Molecular FormulaC30H31ClN6O3
  • Average mass559.058 Da
  • Monoisotopic mass558.214600 Da
  • ChemSpider ID24697595

More details:

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

Benzamide, N-[3-[[5-chloro-4-(4-methyl-1-piperazinyl)-6-oxo-1(6H)-pyridazinyl]methyl]-2-methylphenyl]-4-(6-methoxy-3-pyridinyl)- [ACD/Index Name]
N-(3-{[5-Chlor-4-(4-methyl-1-piperazinyl)-6-oxo-1(6H)-pyridazinyl]methyl}-2-methylphenyl)-4-(6-methoxy-3-pyridinyl)benzamid [German] [ACD/IUPAC Name]
N-(3-{[5-Chloro-4-(4-methyl-1-piperazinyl)-6-oxo-1(6H)-pyridazinyl]methyl}-2-methylphenyl)-4-(6-methoxy-3-pyridinyl)benzamide [ACD/IUPAC Name]
N-(3-{[5-Chloro-4-(4-méthyl-1-pipérazinyl)-6-oxo-1(6H)-pyridazinyl]méthyl}-2-méthylphényl)-4-(6-méthoxy-3-pyridinyl)benzamide [French] [ACD/IUPAC Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL475282/
N-(3-((5-chloro-4-(4-methylpiperazin-1-yl)-6-oxopyridazin-1(6H)-yl)methyl)-2-methylphenyl)-4-(6-methoxypyridin-3-yl)benzamide

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.654
Molar Refractivity: 156.2±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 3.30
ACD/LogD (pH 5.5): 1.15
ACD/BCF (pH 5.5): 1.53
ACD/KOC (pH 5.5): 13.41
ACD/LogD (pH 7.4): 2.75
ACD/BCF (pH 7.4): 60.44
ACD/KOC (pH 7.4): 530.36
Polar Surface Area: 90 Å2
Polarizability: 61.9±0.5 10-24cm3
Surface Tension: 50.6±7.0 dyne/cm
Molar Volume: 426.4±7.0 cm3

Click to predict properties on the Chemicalize site


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