ChemSpider 2D Image | 5-Bromo-N-(4-carbamoyl-1-methyl-1H-pyrazol-3-yl)-2-pyridinecarboxamide | C11H10BrN5O2

5-Bromo-N-(4-carbamoyl-1-methyl-1H-pyrazol-3-yl)-2-pyridinecarboxamide

  • Molecular FormulaC11H10BrN5O2
  • Average mass324.133 Da
  • Monoisotopic mass323.001770 Da
  • ChemSpider ID35225783

More details:

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

2-Pyridinecarboxamide, N-[4-(aminocarbonyl)-1-methyl-1H-pyrazol-3-yl]-5-bromo- [ACD/Index Name]
5-Brom-N-(4-carbamoyl-1-methyl-1H-pyrazol-3-yl)-2-pyridincarboxamid [German] [ACD/IUPAC Name]
5-Bromo-N-(4-carbamoyl-1-methyl-1H-pyrazol-3-yl)-2-pyridinecarboxamide [ACD/IUPAC Name]
5-Bromo-N-(4-carbamoyl-1-méthyl-1H-pyrazol-3-yl)-2-pyridinecarboxamide [French] [ACD/IUPAC Name]
5-BROMO-N-(4-CARBAMOYL-1-METHYL-1H-PYRAZOL-3-YL)PYRIDINE-2-CARBOXAMIDE
5-BROMO-N-(4-CARBAMOYL-1-METHYLPYRAZOL-3-YL)PYRIDINE-2-CARBOXAMIDE

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

Density: 1.8±0.1 g/cm3
Boiling Point: 447.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.6±3.0 kJ/mol
Flash Point: 224.4±28.7 °C
Index of Refraction: 1.732
Molar Refractivity: 72.2±0.5 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.42
ACD/LogD (pH 5.5): 1.13
ACD/BCF (pH 5.5): 4.22
ACD/KOC (pH 5.5): 97.57
ACD/LogD (pH 7.4): 1.13
ACD/BCF (pH 7.4): 4.22
ACD/KOC (pH 7.4): 97.53
Polar Surface Area: 103 Å2
Polarizability: 28.6±0.5 10-24cm3
Surface Tension: 67.2±7.0 dyne/cm
Molar Volume: 180.7±7.0 cm3

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