ChemSpider 2D Image | N-[3-(3-Chloro-4-fluorophenyl)-1H-1,2,4-triazol-5-yl]-2-[4-(1H-pyrrol-1-yl)tetrahydro-2H-pyran-4-yl]acetamide | C19H19ClFN5O2

N-[3-(3-Chloro-4-fluorophenyl)-1H-1,2,4-triazol-5-yl]-2-[4-(1H-pyrrol-1-yl)tetrahydro-2H-pyran-4-yl]acetamide

  • Molecular FormulaC19H19ClFN5O2
  • Average mass403.838 Da
  • Monoisotopic mass403.121124 Da
  • ChemSpider ID57574374

More details:

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

2H-Pyran-4-acetamide, N-[3-(3-chloro-4-fluorophenyl)-1H-1,2,4-triazol-5-yl]tetrahydro-4-(1H-pyrrol-1-yl)- [ACD/Index Name]
N-[3-(3-Chlor-4-fluorphenyl)-1H-1,2,4-triazol-5-yl]-2-[4-(1H-pyrrol-1-yl)tetrahydro-2H-pyran-4-yl]acetamid [German] [ACD/IUPAC Name]
N-[3-(3-Chloro-4-fluorophenyl)-1H-1,2,4-triazol-5-yl]-2-[4-(1H-pyrrol-1-yl)tetrahydro-2H-pyran-4-yl]acetamide [ACD/IUPAC Name]
N-[3-(3-Chloro-4-fluorophényl)-1H-1,2,4-triazol-5-yl]-2-[4-(1H-pyrrol-1-yl)tétrahydro-2H-pyran-4-yl]acétamide [French] [ACD/IUPAC Name]
2-(4-(1H-pyrrol-1-yl)tetrahydro-2H-pyran-4-yl)-N-(5-(3-chloro-4-fluorophenyl)-1H-1,2,4-triazol-3-yl)acetamide
N-[5-(3-chloro-4-fluorophenyl)-1H-1,2,4-triazol-3-yl]-2-[4-(1H-pyrrol-1-yl)tetrahydro-2H-pyran-4-yl]acetamide

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.674
Molar Refractivity: 103.3±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.52
ACD/LogD (pH 5.5): 3.24
ACD/BCF (pH 5.5): 169.41
ACD/KOC (pH 5.5): 1370.97
ACD/LogD (pH 7.4): 3.22
ACD/BCF (pH 7.4): 164.24
ACD/KOC (pH 7.4): 1329.11
Polar Surface Area: 85 Å2
Polarizability: 41.0±0.5 10-24cm3
Surface Tension: 55.3±7.0 dyne/cm
Molar Volume: 275.3±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement