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

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

  • Molecular FormulaC25H30Cl2N6
  • Average mass485.452 Da
  • Monoisotopic mass484.190887 Da
  • ChemSpider ID121565099

More details:

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

4,6-Pyrimidinediamine, N6-(4-chloro-3-methylphenyl)-N4-(2-chlorophenyl)-2-methyl-N4-[2-(4-methyl-1-piperazinyl)ethyl]- [ACD/Index Name]
N'-(4-Chlor-3-methylphenyl)-N-(2-chlorphenyl)-2-methyl-N-[2-(4-methyl-1-piperazinyl)ethyl]-4,6-pyrimidindiamin [German] [ACD/IUPAC Name]
N'-(4-Chloro-3-methylphenyl)-N-(2-chlorophenyl)-2-methyl-N-[2-(4-methyl-1-piperazinyl)ethyl]-4,6-pyrimidinediamine [ACD/IUPAC Name]
N'-(4-Chloro-3-méthylphényl)-N-(2-chlorophényl)-2-méthyl-N-[2-(4-méthyl-1-pipérazinyl)éthyl]-4,6-pyrimidinediamine [French] [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: 627.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.9±3.0 kJ/mol
Flash Point: 333.4±31.5 °C
Index of Refraction: 1.639
Molar Refractivity: 138.3±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 6.05
ACD/LogD (pH 5.5): 2.42
ACD/BCF (pH 5.5): 7.59
ACD/KOC (pH 5.5): 20.42
ACD/LogD (pH 7.4): 4.98
ACD/BCF (pH 7.4): 2775.15
ACD/KOC (pH 7.4): 7466.81
Polar Surface Area: 48 Å2
Polarizability: 54.8±0.5 10-24cm3
Surface Tension: 55.8±3.0 dyne/cm
Molar Volume: 384.0±3.0 cm3

Click to predict properties on the Chemicalize site


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