ChemSpider 2D Image | AZ 960 | C18H16F2N6

AZ 960

  • Molecular FormulaC18H16F2N6
  • Average mass354.357 Da
  • Monoisotopic mass354.140442 Da
  • ChemSpider ID26348413

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(S)-5-fluoro-2-((1-(4-fluorophenyl)ethyl)amino)-6-((5-methyl-1H-pyrazol-3-yl)amino)nicotinonitrile
3-Pyridinecarbonitrile, 5-fluoro-2-[[(1S)-1-(4-fluorophenyl)ethyl]amino]-6-[(5-methyl-1H-pyrazol-3-yl)amino]- [ACD/Index Name]
5-Fluor-2-{[(1S)-1-(4-fluorphenyl)ethyl]amino}-6-[(5-methyl-1H-pyrazol-3-yl)amino]nicotinonitril [German] [ACD/IUPAC Name]
5-Fluoro-2-{[(1S)-1-(4-fluorophenyl)ethyl]amino}-6-[(5-methyl-1H-pyrazol-3-yl)amino]nicotinonitrile [ACD/IUPAC Name]
5-Fluoro-2-{[(1S)-1-(4-fluorophényl)éthyl]amino}-6-[(5-méthyl-1H-pyrazol-3-yl)amino]nicotinonitrile [French] [ACD/IUPAC Name]
5-fluoro-2-{[(1S)-1-(4-fluorophenyl)ethyl]amino}-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyridine-3-carbonitrile
905586-69-8 [RN]
AZ 960
AZ-960
(S)-5-fluoro-2-(1-(4-fluorophenyl)ethylamino)-6-(5-methyl-1H-pyrazol-3-ylamino)nicotinonitrile
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 515.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.7±3.0 kJ/mol
Flash Point: 265.4±30.1 °C
Index of Refraction: 1.628
Molar Refractivity: 91.6±0.4 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 6.09
ACD/LogD (pH 5.5): 4.52
ACD/BCF (pH 5.5): 1591.13
ACD/KOC (pH 5.5): 6808.24
ACD/LogD (pH 7.4): 4.52
ACD/BCF (pH 7.4): 1595.51
ACD/KOC (pH 7.4): 6826.98
Polar Surface Area: 89 Å2
Polarizability: 36.3±0.5 10-24cm3
Surface Tension: 66.5±5.0 dyne/cm
Molar Volume: 258.1±5.0 cm3

Click to predict properties on the Chemicalize site


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