ChemSpider 2D Image | N-(4-Chloro-2-methylphenyl)-6-[4-(3-chlorophenoxy)-1-piperidinyl]-2-(3-pyridinyl)-4-pyrimidinamine | C27H25Cl2N5O

N-(4-Chloro-2-methylphenyl)-6-[4-(3-chlorophenoxy)-1-piperidinyl]-2-(3-pyridinyl)-4-pyrimidinamine

  • Molecular FormulaC27H25Cl2N5O
  • Average mass506.426 Da
  • Monoisotopic mass505.143616 Da
  • ChemSpider ID121633858

More details:

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

4-Pyrimidinamine, N-(4-chloro-2-methylphenyl)-6-[4-(3-chlorophenoxy)-1-piperidinyl]-2-(3-pyridinyl)- [ACD/Index Name]
N-(4-Chlor-2-methylphenyl)-6-[4-(3-chlorphenoxy)-1-piperidinyl]-2-(3-pyridinyl)-4-pyrimidinamin [German] [ACD/IUPAC Name]
N-(4-Chloro-2-methylphenyl)-6-[4-(3-chlorophenoxy)-1-piperidinyl]-2-(3-pyridinyl)-4-pyrimidinamine [ACD/IUPAC Name]
N-(4-Chloro-2-méthylphényl)-6-[4-(3-chlorophénoxy)-1-pipéridinyl]-2-(3-pyridinyl)-4-pyrimidinamine [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: 617.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.6±3.0 kJ/mol
Flash Point: 327.5±31.5 °C
Index of Refraction: 1.654
Molar Refractivity: 140.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 6.08
ACD/LogD (pH 5.5): 5.09
ACD/BCF (pH 5.5): 2418.88
ACD/KOC (pH 5.5): 4640.07
ACD/LogD (pH 7.4): 6.08
ACD/BCF (pH 7.4): 23728.27
ACD/KOC (pH 7.4): 45517.34
Polar Surface Area: 63 Å2
Polarizability: 55.6±0.5 10-24cm3
Surface Tension: 60.1±3.0 dyne/cm
Molar Volume: 382.4±3.0 cm3

Click to predict properties on the Chemicalize site


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