ChemSpider 2D Image | AMG319 | C21H16FN7


  • Molecular FormulaC21H16FN7
  • Average mass385.397 Da
  • Monoisotopic mass385.145111 Da
  • ChemSpider ID35000181
  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1608125-21-8 [RN]
3-Quinolinemethanamine, 7-fluoro-α-methyl-N-9H-purin-6-yl-2-(2-pyridinyl)-, (αS)- [ACD/Index Name]
AMG319 [Wiki]
N-{(1S)-1-[7-Fluor-2-(2-pyridinyl)-3-chinolinyl]ethyl}-9H-purin-6-amin [German] [ACD/IUPAC Name]
N-{(1S)-1-[7-Fluoro-2-(2-pyridinyl)-3-quinoléinyl]éthyl}-9H-purin-6-amine [French] [ACD/IUPAC Name]
N-{(1S)-1-[7-Fluoro-2-(2-pyridinyl)-3-quinolinyl]ethyl}-9H-purin-6-amine [ACD/IUPAC Name]
3-Quinolinemethanamine, 7-fluoro-a-methyl-N-9H-purin-6-yl-2-(2-pyridinyl)-, (aS)-
  • Experimental Physico-chemical Properties
  • Miscellaneous
    • Bio Activity:

      AMG319 is a potent and selective PI3K? inhibitor with IC50 of 18 nM, also inhibits PI3K? with IC50 of 850 nM.; IC50: 18 nM (PI3K?), 850 nM (PI3K?), 2.7?M (PI3K?), 33 ?M (PI3K?); Target: PI3K; In vitro: AMG319 is a compound with an IC50 of 16 nM in a human whole blood assay (HWB), excellent selectivity over a large panel of protein kinases, and a high level of in vivo efficacy as measured by two rodent disease models of inflammation. MedChem Express HY-12948
      PI3K MedChem Express HY-12948
      PI3K/Akt/mTOR MedChem Express HY-12948
      PI3K/Akt/mTOR; MedChem Express HY-12948

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.755
Molar Refractivity: 110.1±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.90
ACD/LogD (pH 5.5): 3.71
ACD/BCF (pH 5.5): 387.68
ACD/KOC (pH 5.5): 2475.98
ACD/LogD (pH 7.4): 3.71
ACD/BCF (pH 7.4): 388.47
ACD/KOC (pH 7.4): 2481.02
Polar Surface Area: 92 Å2
Polarizability: 43.7±0.5 10-24cm3
Surface Tension: 76.4±3.0 dyne/cm
Molar Volume: 269.0±3.0 cm3

Click to predict properties on the Chemicalize site

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