ChemSpider 2D Image | 1-[(4-Bromo-1H-pyrazol-1-yl)methyl]-N-(3-pyridinylmethyl)-1H-pyrazole-3-carboxamide | C14H13BrN6O

1-[(4-Bromo-1H-pyrazol-1-yl)methyl]-N-(3-pyridinylmethyl)-1H-pyrazole-3-carboxamide

  • Molecular FormulaC14H13BrN6O
  • Average mass361.197 Da
  • Monoisotopic mass360.033417 Da
  • ChemSpider ID21484080

More details:

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

1-[(4-Brom-1H-pyrazol-1-yl)methyl]-N-(3-pyridinylmethyl)-1H-pyrazol-3-carboxamid [German] [ACD/IUPAC Name]
1-[(4-Bromo-1H-pyrazol-1-yl)methyl]-N-(3-pyridinylmethyl)-1H-pyrazole-3-carboxamide [ACD/IUPAC Name]
1-[(4-Bromo-1H-pyrazol-1-yl)méthyl]-N-(3-pyridinylméthyl)-1H-pyrazole-3-carboxamide [French] [ACD/IUPAC Name]
1H-Pyrazole-3-carboxamide, 1-[(4-bromo-1H-pyrazol-1-yl)methyl]-N-(3-pyridinylmethyl)- [ACD/Index Name]
1-[(4-bromo-1H-pyrazol-1-yl)methyl]-N-[(pyridin-3-yl)methyl]-1H-pyrazole-3-carboxamide
1-[(4-BROMOPYRAZOL-1-YL)METHYL]-N-(PYRIDIN-3-YLMETHYL)PYRAZOLE-3-CARBOXAMIDE

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

Density: 1.6±0.1 g/cm3
Boiling Point: 651.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.1±3.0 kJ/mol
Flash Point: 348.1±31.5 °C
Index of Refraction: 1.720
Molar Refractivity: 88.0±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.42
ACD/LogD (pH 5.5): 0.96
ACD/BCF (pH 5.5): 3.03
ACD/KOC (pH 5.5): 74.05
ACD/LogD (pH 7.4): 1.01
ACD/BCF (pH 7.4): 3.48
ACD/KOC (pH 7.4): 84.89
Polar Surface Area: 78 Å2
Polarizability: 34.9±0.5 10-24cm3
Surface Tension: 62.8±7.0 dyne/cm
Molar Volume: 222.7±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement