ChemSpider 2D Image | N-(3,4-Difluorophenyl)-2-[2-(4-fluorophenyl)-3-(hydroxymethyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]acetamide | C21H15F3N4O3

N-(3,4-Difluorophenyl)-2-[2-(4-fluorophenyl)-3-(hydroxymethyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]acetamide

  • Molecular FormulaC21H15F3N4O3
  • Average mass428.364 Da
  • Monoisotopic mass428.109619 Da
  • ChemSpider ID35294986

More details:

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

N-(3,4-Difluorophenyl)-2-[2-(4-fluorophenyl)-3-(hydroxymethyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]acetamide [ACD/IUPAC Name]
N-(3,4-Difluorophényl)-2-[2-(4-fluorophényl)-3-(hydroxyméthyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]acétamide [French] [ACD/IUPAC Name]
N-(3,4-Difluorphenyl)-2-[2-(4-fluorphenyl)-3-(hydroxymethyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]acetamid [German] [ACD/IUPAC Name]
Pyrazolo[1,5-a]pyrazine-5(4H)-acetamide, N-(3,4-difluorophenyl)-2-(4-fluorophenyl)-3-(hydroxymethyl)-4-oxo- [ACD/Index Name]
1775305-97-9 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 623.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 97.1±3.0 kJ/mol
Flash Point: 330.8±31.5 °C
Index of Refraction: 1.652
Molar Refractivity: 105.3±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.16
ACD/LogD (pH 5.5): 1.67
ACD/BCF (pH 5.5): 11.02
ACD/KOC (pH 5.5): 193.98
ACD/LogD (pH 7.4): 1.67
ACD/BCF (pH 7.4): 11.02
ACD/KOC (pH 7.4): 193.98
Polar Surface Area: 87 Å2
Polarizability: 41.8±0.5 10-24cm3
Surface Tension: 51.5±7.0 dyne/cm
Molar Volume: 287.9±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement