ChemSpider 2D Image | N-[3-(5-Amino-4-cyano-1-phenyl-1H-pyrazol-3-yl)propyl]-2-chloro-4,5-difluorobenzamide | C20H16ClF2N5O

N-[3-(5-Amino-4-cyano-1-phenyl-1H-pyrazol-3-yl)propyl]-2-chloro-4,5-difluorobenzamide

  • Molecular FormulaC20H16ClF2N5O
  • Average mass415.824 Da
  • Monoisotopic mass415.101135 Da
  • ChemSpider ID30516980

More details:

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

Benzamide, N-[3-(5-amino-4-cyano-1-phenyl-1H-pyrazol-3-yl)propyl]-2-chloro-4,5-difluoro- [ACD/Index Name]
N-[3-(5-Amino-4-cyan-1-phenyl-1H-pyrazol-3-yl)propyl]-2-chlor-4,5-difluorbenzamid [German] [ACD/IUPAC Name]
N-[3-(5-Amino-4-cyano-1-phenyl-1H-pyrazol-3-yl)propyl]-2-chloro-4,5-difluorobenzamide [ACD/IUPAC Name]
N-[3-(5-Amino-4-cyano-1-phényl-1H-pyrazol-3-yl)propyl]-2-chloro-4,5-difluorobenzamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 585.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.5±3.0 kJ/mol
Flash Point: 308.1±30.1 °C
Index of Refraction: 1.639
Molar Refractivity: 106.2±0.5 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.34
ACD/LogD (pH 5.5): 3.22
ACD/BCF (pH 5.5): 164.05
ACD/KOC (pH 5.5): 1339.97
ACD/LogD (pH 7.4): 3.22
ACD/BCF (pH 7.4): 164.05
ACD/KOC (pH 7.4): 1339.96
Polar Surface Area: 97 Å2
Polarizability: 42.1±0.5 10-24cm3
Surface Tension: 50.1±7.0 dyne/cm
Molar Volume: 295.0±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement