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Search term: GKLWKLSTEFNVDD (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 3-(4-Fluorophenyl)-1-methyl-N-(4-{[6-methyl-2-(4-morpholinyl)-4-pyrimidinyl]amino}phenyl)-1H-pyrazole-5-carboxamide | C26H26FN7O2

3-(4-Fluorophenyl)-1-methyl-N-(4-{[6-methyl-2-(4-morpholinyl)-4-pyrimidinyl]amino}phenyl)-1H-pyrazole-5-carboxamide

  • Molecular FormulaC26H26FN7O2
  • Average mass487.529 Da
  • Monoisotopic mass487.213196 Da
  • ChemSpider ID58491937

More details:






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

1H-Pyrazole-5-carboxamide, 3-(4-fluorophenyl)-1-methyl-N-[4-[[6-methyl-2-(4-morpholinyl)-4-pyrimidinyl]amino]phenyl]- [ACD/Index Name]
3-(4-Fluorophenyl)-1-methyl-N-(4-{[6-methyl-2-(4-morpholinyl)-4-pyrimidinyl]amino}phenyl)-1H-pyrazole-5-carboxamide [ACD/IUPAC Name]
3-(4-Fluorophényl)-1-méthyl-N-(4-{[6-méthyl-2-(4-morpholinyl)-4-pyrimidinyl]amino}phényl)-1H-pyrazole-5-carboxamide [French] [ACD/IUPAC Name]
3-(4-Fluorphenyl)-1-methyl-N-(4-{[6-methyl-2-(4-morpholinyl)-4-pyrimidinyl]amino}phenyl)-1H-pyrazol-5-carboxamid [German] [ACD/IUPAC Name]
3-(4-fluorophenyl)-1-methyl-N-(4-((6-methyl-2-morpholinopyrimidin-4-yl)amino)phenyl)-1H-pyrazole-5-carboxamide

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.675
Molar Refractivity: 134.6±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.83
ACD/LogD (pH 5.5): 1.26
ACD/BCF (pH 5.5): 1.46
ACD/KOC (pH 5.5): 9.68
ACD/LogD (pH 7.4): 2.57
ACD/BCF (pH 7.4): 29.33
ACD/KOC (pH 7.4): 195.16
Polar Surface Area: 97 Å2
Polarizability: 53.3±0.5 10-24cm3
Surface Tension: 51.9±7.0 dyne/cm
Molar Volume: 358.1±7.0 cm3

Click to predict properties on the Chemicalize site






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