ChemSpider 2D Image | N~4~'-(3-{[5-Chloro-6-oxo-4-(1-piperazinyl)-1(6H)-pyridazinyl]methyl}-2-methylphenyl)-3,4'-biphenyldicarboxamide | C30H29ClN6O3

N4'-(3-{[5-Chloro-6-oxo-4-(1-piperazinyl)-1(6H)-pyridazinyl]methyl}-2-methylphenyl)-3,4'-biphenyldicarboxamide

  • Molecular FormulaC30H29ClN6O3
  • Average mass557.043 Da
  • Monoisotopic mass556.198975 Da
  • ChemSpider ID24697040

More details:

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

[1,1'-Biphenyl]-3,4'-dicarboxamide, N4'-[3-[[5-chloro-6-oxo-4-(1-piperazinyl)-1(6H)-pyridazinyl]methyl]-2-methylphenyl]- [ACD/Index Name]
N4'-(3-{[5-Chlor-6-oxo-4-(1-piperazinyl)-1(6H)-pyridazinyl]methyl}-2-methylphenyl)-3,4'-biphenyldicarboxamid [German] [ACD/IUPAC Name]
N4'-(3-{[5-Chloro-6-oxo-4-(1-piperazinyl)-1(6H)-pyridazinyl]methyl}-2-methylphenyl)-3,4'-biphenyldicarboxamide [ACD/IUPAC Name]
N4'-(3-{[5-Chloro-6-oxo-4-(1-pipérazinyl)-1(6H)-pyridazinyl]méthyl}-2-méthylphényl)-3,4'-biphényldicarboxamide [French] [ACD/IUPAC Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL474474/

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.686
Molar Refractivity: 154.0±0.5 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 2.25
ACD/LogD (pH 5.5): -0.55
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.97
ACD/BCF (pH 7.4): 1.54
ACD/KOC (pH 7.4): 19.73
Polar Surface Area: 120 Å2
Polarizability: 61.1±0.5 10-24cm3
Surface Tension: 56.8±7.0 dyne/cm
Molar Volume: 404.9±7.0 cm3

Click to predict properties on the Chemicalize site


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