ChemSpider 2D Image | N-(2-Chlorophenyl)-N'-(3-chlorophenyl)-2-ethyl-N-[2-(4-methyl-1-piperazinyl)ethyl]-4,6-pyrimidinediamine | C25H30Cl2N6

N-(2-Chlorophenyl)-N'-(3-chlorophenyl)-2-ethyl-N-[2-(4-methyl-1-piperazinyl)ethyl]-4,6-pyrimidinediamine

  • Molecular FormulaC25H30Cl2N6
  • Average mass485.452 Da
  • Monoisotopic mass484.190887 Da
  • ChemSpider ID121453554

More details:

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

4,6-Pyrimidinediamine, N4-(2-chlorophenyl)-N6-(3-chlorophenyl)-2-ethyl-N4-[2-(4-methyl-1-piperazinyl)ethyl]- [ACD/Index Name]
N-(2-Chlorophenyl)-N'-(3-chlorophenyl)-2-ethyl-N-[2-(4-methyl-1-piperazinyl)ethyl]-4,6-pyrimidinediamine [ACD/IUPAC Name]
N-(2-Chlorophényl)-N'-(3-chlorophényl)-2-éthyl-N-[2-(4-méthyl-1-pipérazinyl)éthyl]-4,6-pyrimidinediamine [French] [ACD/IUPAC Name]
N-(2-Chlorphenyl)-N'-(3-chlorphenyl)-2-ethyl-N-[2-(4-methyl-1-piperazinyl)ethyl]-4,6-pyrimidindiamin [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: 627.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.8±3.0 kJ/mol
Flash Point: 333.1±31.5 °C
Index of Refraction: 1.638
Molar Refractivity: 138.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 6.02
ACD/LogD (pH 5.5): 2.55
ACD/BCF (pH 5.5): 9.73
ACD/KOC (pH 5.5): 25.07
ACD/LogD (pH 7.4): 5.07
ACD/BCF (pH 7.4): 3265.82
ACD/KOC (pH 7.4): 8416.34
Polar Surface Area: 48 Å2
Polarizability: 54.8±0.5 10-24cm3
Surface Tension: 56.0±3.0 dyne/cm
Molar Volume: 384.3±3.0 cm3

Click to predict properties on the Chemicalize site


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