ChemSpider 2D Image | N-(2-Fluorobenzyl)-2-{4-[1-(4-fluorophenyl)-1H-pyrazol-4-yl]-3,6-dihydro-1(2H)-pyridinyl}acetamide | C23H22F2N4O

N-(2-Fluorobenzyl)-2-{4-[1-(4-fluorophenyl)-1H-pyrazol-4-yl]-3,6-dihydro-1(2H)-pyridinyl}acetamide

  • Molecular FormulaC23H22F2N4O
  • Average mass408.444 Da
  • Monoisotopic mass408.176178 Da
  • ChemSpider ID29042695

More details:

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

1(2H)-Pyridineacetamide, N-[(2-fluorophenyl)methyl]-4-[1-(4-fluorophenyl)-1H-pyrazol-4-yl]-3,6-dihydro- [ACD/Index Name]
N-(2-Fluorbenzyl)-2-{4-[1-(4-fluorphenyl)-1H-pyrazol-4-yl]-3,6-dihydro-1(2H)-pyridinyl}acetamid [German] [ACD/IUPAC Name]
N-(2-Fluorobenzyl)-2-{4-[1-(4-fluorophenyl)-1H-pyrazol-4-yl]-3,6-dihydro-1(2H)-pyridinyl}acetamide [ACD/IUPAC Name]
N-(2-Fluorobenzyl)-2-{4-[1-(4-fluorophényl)-1H-pyrazol-4-yl]-3,6-dihydro-1(2H)-pyridinyl}acétamide [French] [ACD/IUPAC Name]
N-(2-fluorobenzyl)-2-[4-[1-(4-fluorophenyl)-1H-pyrazol-4-yl]-3,6-dihydropyridin-1(2H)-yl]acetamide

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

Density: 1.3±0.1 g/cm3
Boiling Point: 609.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.6±3.0 kJ/mol
Flash Point: 322.7±31.5 °C
Index of Refraction: 1.617
Molar Refractivity: 113.0±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.29
ACD/LogD (pH 5.5): 2.67
ACD/BCF (pH 5.5): 47.38
ACD/KOC (pH 5.5): 392.24
ACD/LogD (pH 7.4): 3.18
ACD/BCF (pH 7.4): 152.01
ACD/KOC (pH 7.4): 1258.53
Polar Surface Area: 50 Å2
Polarizability: 44.8±0.5 10-24cm3
Surface Tension: 45.3±7.0 dyne/cm
Molar Volume: 322.6±7.0 cm3

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