ChemSpider 2D Image | 1-[4-(4-Fluorophenyl)-5-methyl-2-pyrimidinyl]-N-(2-hydroxybutyl)-5-isopropyl-1H-pyrazole-4-carboxamide | C22H26FN5O2

1-[4-(4-Fluorophenyl)-5-methyl-2-pyrimidinyl]-N-(2-hydroxybutyl)-5-isopropyl-1H-pyrazole-4-carboxamide

  • Molecular FormulaC22H26FN5O2
  • Average mass411.473 Da
  • Monoisotopic mass411.207062 Da
  • ChemSpider ID22195400

More details:

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

1-[4-(4-Fluorophenyl)-5-methyl-2-pyrimidinyl]-N-(2-hydroxybutyl)-5-isopropyl-1H-pyrazole-4-carboxamide [ACD/IUPAC Name]
1-[4-(4-Fluorophényl)-5-méthyl-2-pyrimidinyl]-N-(2-hydroxybutyl)-5-isopropyl-1H-pyrazole-4-carboxamide [French] [ACD/IUPAC Name]
1-[4-(4-Fluorphenyl)-5-methyl-2-pyrimidinyl]-N-(2-hydroxybutyl)-5-isopropyl-1H-pyrazol-4-carboxamid [German] [ACD/IUPAC Name]
1H-Pyrazole-4-carboxamide, 1-[4-(4-fluorophenyl)-5-methyl-2-pyrimidinyl]-N-(2-hydroxybutyl)-5-(1-methylethyl)- [ACD/Index Name]
1-[4-(4-FLUOROPHENYL)-5-METHYLPYRIMIDIN-2-YL]-N-(2-HYDROXYBUTYL)-5-(PROPAN-2-YL)-1H-PYRAZOLE-4-CARBOXAMIDE
1-[4-(4-FLUOROPHENYL)-5-METHYLPYRIMIDIN-2-YL]-N-(2-HYDROXYBUTYL)-5-ISOPROPYLPYRAZOLE-4-CARBOXAMIDE

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.615
Molar Refractivity: 113.3±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.83
ACD/LogD (pH 5.5): 2.27
ACD/BCF (pH 5.5): 31.51
ACD/KOC (pH 5.5): 411.37
ACD/LogD (pH 7.4): 2.27
ACD/BCF (pH 7.4): 31.51
ACD/KOC (pH 7.4): 411.37
Polar Surface Area: 93 Å2
Polarizability: 44.9±0.5 10-24cm3
Surface Tension: 43.6±7.0 dyne/cm
Molar Volume: 324.6±7.0 cm3

Click to predict properties on the Chemicalize site


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