ChemSpider 2D Image | 5-Chloro-N~4~-[2-(methylsulfonyl)phenyl]-N~2~-phenyl-2,4-pyrimidinediamine | C17H15ClN4O2S

5-Chloro-N4-[2-(methylsulfonyl)phenyl]-N2-phenyl-2,4-pyrimidinediamine

  • Molecular FormulaC17H15ClN4O2S
  • Average mass374.845 Da
  • Monoisotopic mass374.060425 Da
  • ChemSpider ID24808873

More details:

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

2,4-Pyrimidinediamine, 5-chloro-N4-[2-(methylsulfonyl)phenyl]-N2-phenyl- [ACD/Index Name]
5-Chlor-N4-[2-(methylsulfonyl)phenyl]-N2-phenyl-2,4-pyrimidindiamin [German] [ACD/IUPAC Name]
5-Chloro-N4-[2-(methylsulfonyl)phenyl]-N2-phenyl-2,4-pyrimidinediamine [ACD/IUPAC Name]
5-Chloro-N4-[2-(méthylsulfonyl)phényl]-N2-phényl-2,4-pyrimidinediamine [French] [ACD/IUPAC Name]
Kinome_1262

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

Density: 1.4±0.1 g/cm3
Boiling Point: 601.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.5±3.0 kJ/mol
Flash Point: 317.3±34.3 °C
Index of Refraction: 1.666
Molar Refractivity: 97.3±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.75
ACD/LogD (pH 5.5): 3.55
ACD/BCF (pH 5.5): 291.88
ACD/KOC (pH 5.5): 2015.04
ACD/LogD (pH 7.4): 3.56
ACD/BCF (pH 7.4): 296.39
ACD/KOC (pH 7.4): 2046.19
Polar Surface Area: 92 Å2
Polarizability: 38.6±0.5 10-24cm3
Surface Tension: 68.3±3.0 dyne/cm
Molar Volume: 261.7±3.0 cm3

Click to predict properties on the Chemicalize site


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