ChemSpider 2D Image | GNE-493 | C17H20N6O2S

GNE-493

  • Molecular FormulaC17H20N6O2S
  • Average mass372.445 Da
  • Monoisotopic mass372.136841 Da
  • ChemSpider ID24661579

More details:

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

0L843LS9YK
1033735-94-2 [RN]
2-[2-(2-Amino-5-pyrimidinyl)-4-(4-morpholinyl)thieno[3,2-d]pyrimidin-6-yl]-2-propanol [German] [ACD/IUPAC Name]
2-[2-(2-Amino-5-pyrimidinyl)-4-(4-morpholinyl)thieno[3,2-d]pyrimidin-6-yl]-2-propanol [ACD/IUPAC Name]
2-[2-(2-Amino-5-pyrimidinyl)-4-(4-morpholinyl)thiéno[3,2-d]pyrimidin-6-yl]-2-propanol [French] [ACD/IUPAC Name]
2-[2-(2-Aminopyrimidin-5-yl)-4-(morpholin-4-yl)thieno[3,2-d]pyrimidin-6-yl]propan-2-ol
GNE-493
Thieno[3,2-d]pyrimidine-6-methanol, 2-(2-amino-5-pyrimidinyl)-α,α-dimethyl-4-(4-morpholinyl)- [ACD/Index Name]
[1033735-94-2] [RN]
2-(2-(2-aminopyrimidin-5-yl)-4-morpholinothieno[3,2-d]pyrimidin-6-yl)propan-2-ol
More...
  • Experimental Physico-chemical Properties
  • Miscellaneous

    • Bio Activity:

      GNE-493 is a potent, selective, and orally available dual pan-PI3K/mTOR inhibitor with IC50s of 3.4/12/16/16/32 nM for PI3K?/PI3K?/PI3K?/PI3K?/mTOR respectively.; IC50 value: 3.4/12/16/16/32 nM(PI3K?/PI3K?/PI3K?/PI3K?/mTOR) [1]; Target: pan-PI3K/mTOR inhibitor; GNE-493 has good pharmacokinetic (PK) parameters, GNE-493 is highly selective, demonstrate knock down of pathway markers in vivo, and are efficacious in xenograft models where the PI3K pathway is deregulated. MedChem Express HY-10811
      mTOR MedChem Express HY-10811
      mTOR PI3K MedChem Express HY-10811
      PI3K/Akt/mTOR MedChem Express HY-10811
      PI3K/Akt/mTOR; MedChem Express HY-10811

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

Density: 1.4±0.1 g/cm3
Boiling Point: 585.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 91.9±3.0 kJ/mol
Flash Point: 307.6±32.9 °C
Index of Refraction: 1.687
Molar Refractivity: 100.8±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.02
ACD/LogD (pH 5.5): 1.40
ACD/BCF (pH 5.5): 6.84
ACD/KOC (pH 5.5): 137.13
ACD/LogD (pH 7.4): 1.41
ACD/BCF (pH 7.4): 6.96
ACD/KOC (pH 7.4): 139.61
Polar Surface Area: 139 Å2
Polarizability: 39.9±0.5 10-24cm3
Surface Tension: 77.5±3.0 dyne/cm
Molar Volume: 264.5±3.0 cm3

Click to predict properties on the Chemicalize site


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