ChemSpider 2D Image | 5-Bromo-N~4~-(2-methoxyphenyl)-N~2~-(1-methyl-1H-pyrazol-4-yl)-2,4-pyrimidinediamine | C15H15BrN6O

5-Bromo-N4-(2-methoxyphenyl)-N2-(1-methyl-1H-pyrazol-4-yl)-2,4-pyrimidinediamine

  • Molecular FormulaC15H15BrN6O
  • Average mass375.223 Da
  • Monoisotopic mass374.049072 Da
  • ChemSpider ID24808888

More details:

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

2,4-Pyrimidinediamine, 5-bromo-N4-(2-methoxyphenyl)-N2-(1-methyl-1H-pyrazol-4-yl)- [ACD/Index Name]
5-Brom-N4-(2-methoxyphenyl)-N2-(1-methyl-1H-pyrazol-4-yl)-2,4-pyrimidindiamin [German] [ACD/IUPAC Name]
5-Bromo-N4-(2-methoxyphenyl)-N2-(1-methyl-1H-pyrazol-4-yl)-2,4-pyrimidinediamine [ACD/IUPAC Name]
5-Bromo-N4-(2-méthoxyphényl)-N2-(1-méthyl-1H-pyrazol-4-yl)-2,4-pyrimidinediamine [French] [ACD/IUPAC Name]
Kinome_1223

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

Density: 1.6±0.1 g/cm3
Boiling Point: 544.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.3±3.0 kJ/mol
Flash Point: 282.8±32.9 °C
Index of Refraction: 1.690
Molar Refractivity: 91.8±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.64
ACD/LogD (pH 5.5): 2.69
ACD/BCF (pH 5.5): 63.72
ACD/KOC (pH 5.5): 666.74
ACD/LogD (pH 7.4): 2.72
ACD/BCF (pH 7.4): 68.57
ACD/KOC (pH 7.4): 717.47
Polar Surface Area: 77 Å2
Polarizability: 36.4±0.5 10-24cm3
Surface Tension: 53.5±7.0 dyne/cm
Molar Volume: 240.2±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement