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Search term: RYQBKVFFHMNFTM-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 5-(Aminomethyl)-N-{3-fluoro-4-[(7-methoxy-4-quinolinyl)oxy]phenyl}-1-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazole-4-carboxamide | C28H24FN5O4

5-(Aminomethyl)-N-{3-fluoro-4-[(7-methoxy-4-quinolinyl)oxy]phenyl}-1-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazole-4-carboxamide

  • Molecular FormulaC28H24FN5O4
  • Average mass513.520 Da
  • Monoisotopic mass513.181213 Da
  • ChemSpider ID10137456

More details:

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

1H-Pyrazole-4-carboxamide, 5-(aminomethyl)-N-[3-fluoro-4-[(7-methoxy-4-quinolinyl)oxy]phenyl]-2,3-dihydro-1-methyl-3-oxo-2-phenyl- [ACD/Index Name]
5-(Aminomethyl)-N-{3-fluor-4-[(7-methoxy-4-chinolinyl)oxy]phenyl}-1-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-carboxamid [German] [ACD/IUPAC Name]
5-(Aminométhyl)-N-{3-fluoro-4-[(7-méthoxy-4-quinoléinyl)oxy]phényl}-1-méthyl-3-oxo-2-phényl-2,3-dihydro-1H-pyrazole-4-carboxamide [French] [ACD/IUPAC Name]
5-(Aminomethyl)-N-{3-fluoro-4-[(7-methoxy-4-quinolinyl)oxy]phenyl}-1-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazole-4-carboxamide [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.686
Molar Refractivity: 140.9±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 3.71
ACD/LogD (pH 5.5): -0.84
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.54
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 110 Å2
Polarizability: 55.8±0.5 10-24cm3
Surface Tension: 64.3±3.0 dyne/cm
Molar Volume: 370.3±3.0 cm3

Click to predict properties on the Chemicalize site


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