ChemSpider 2D Image | 3-Bromo-N-[2-chloro-4-methyl-6-(methylcarbamoyl)phenyl]-1-(3-chloro-2-pyridinyl)-1H-pyrazole-5-carboxamide | C18H14BrCl2N5O2

3-Bromo-N-[2-chloro-4-methyl-6-(methylcarbamoyl)phenyl]-1-(3-chloro-2-pyridinyl)-1H-pyrazole-5-carboxamide

  • Molecular FormulaC18H14BrCl2N5O2
  • Average mass483.146 Da
  • Monoisotopic mass480.970795 Da
  • ChemSpider ID60959066

More details:

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

1H-Pyrazole-5-carboxamide, 3-bromo-N-[2-chloro-4-methyl-6-[(methylamino)carbonyl]phenyl]-1-(3-chloro-2-pyridinyl)- [ACD/Index Name]
3-Brom-N-[2-chlor-4-methyl-6-(methylcarbamoyl)phenyl]-1-(3-chlor-2-pyridinyl)-1H-pyrazol-5-carboxamid [German] [ACD/IUPAC Name]
3-Bromo-N-[2-chloro-4-methyl-6-(methylcarbamoyl)phenyl]-1-(3-chloro-2-pyridinyl)-1H-pyrazole-5-carboxamide [ACD/IUPAC Name]
3-Bromo-N-[2-chloro-4-méthyl-6-(méthylcarbamoyl)phényl]-1-(3-chloro-2-pyridinyl)-1H-pyrazole-5-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 527.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.2±3.0 kJ/mol
Flash Point: 272.9±30.1 °C
Index of Refraction: 1.699
Molar Refractivity: 112.1±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.27
ACD/LogD (pH 5.5): 4.16
ACD/BCF (pH 5.5): 855.21
ACD/KOC (pH 5.5): 4368.96
ACD/LogD (pH 7.4): 4.16
ACD/BCF (pH 7.4): 853.90
ACD/KOC (pH 7.4): 4362.26
Polar Surface Area: 89 Å2
Polarizability: 44.4±0.5 10-24cm3
Surface Tension: 56.4±7.0 dyne/cm
Molar Volume: 290.3±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement