ChemSpider 2D Image | KU-60019 | C30H33N3O5S

KU-60019

  • Molecular FormulaC30H33N3O5S
  • Average mass547.665 Da
  • Monoisotopic mass547.214111 Da
  • ChemSpider ID13095664

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

KU-60019
(2R,6S)-rel-2,6-Dimethyl-N-[5-[6-(4-morpholinyl)-4-oxo-4H-pyran-2-yl]-9H-thioxanthen-2-yl]-4-morpholineacetamide
2-[(2R,6S)-2,6-Dimethyl-4-morpholinyl]-N-{5-[6-(4-morpholinyl)-4-oxo-4H-pyran-2-yl]-9H-thioxanthen-2-yl}acetamid [German] [ACD/IUPAC Name]
2-[(2R,6S)-2,6-Dimethyl-4-morpholinyl]-N-{5-[6-(4-morpholinyl)-4-oxo-4H-pyran-2-yl]-9H-thioxanthen-2-yl}acetamide [ACD/IUPAC Name]
2-[(2R,6S)-2,6-Diméthyl-4-morpholinyl]-N-{5-[6-(4-morpholinyl)-4-oxo-4H-pyran-2-yl]-9H-thioxanthén-2-yl}acétamide [French] [ACD/IUPAC Name]
2-[(2R,6S)-2,6-Dimethylmorpholin-4-yl]-N-{5-[6-(morpholin-4-yl)-4-oxo-4H-pyran-2-yl]-9H-thioxanthen-2-yl}acetamide
2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-{5-[6-(morpholin-4-yl)-4-oxopyran-2-yl]-9H-thioxanthen-2-yl}acetamide
4-Morpholineacetamide, 2,6-dimethyl-N-[5-[6-(4-morpholinyl)-4-oxo-4H-pyran-2-yl]-9H-thioxanthen-2-yl]-, (2R,6S)- [ACD/Index Name]
925701-46-8 [RN]
925701-49-1 [RN]
More...
  • Experimental Physico-chemical Properties
  • Miscellaneous

    • Safety:

      Sold with the permission of AstraZeneca. Tocris Bioscience 4176

    • Bio Activity:

      ATM MedChem Express HY-12061
      ATM & ATR Kinase Tocris Bioscience 4176
      Cell Cycle/DNA Damage MedChem Express HY-12061
      Cell Cycle/DNA Damage; PI3K/Akt/mTOR ; MedChem Express HY-12061
      Enzymes Tocris Bioscience 4176
      Kinases Tocris Bioscience 4176
      KU-60019 is an improved analogue of KU-55933, with IC50 of 6.3 nM for ATM.; IC50 Value: 6.3 nM; Target: ATM; in vitro: KU-60019 effectively radiosensitizes human glioma cells with dose-enhancement ratio of 1.7 and 4.4 at 1 ?M and 10 ?M, respectively, and also radiosensitizes the normal fibroblasts but not the A-T fibroblasts. MedChem Express HY-12061
      Potent ATM kinase inhibitor Tocris Bioscience 4176
      Potent ATM kinase inhibitor (IC50 = 6.3 nM). Exhibits little to no nonspecific target effects against a panel of 229 protein kinases; displays similar target selectivity to KU 55933 (Cat. No. 3544). I nhibits migration and invasion of human glioma cells in vitro. Tocris Bioscience 4176
      Potent ATM kinase inhibitor (IC50 = 6.3 nM). Exhibits little to no nonspecific target effects against a panel of 229 protein kinases; displays similar target selectivity to KU 55933 (Cat. No. 3544). Inhibits migration and invasion of human glioma cells in vitro. Tocris Bioscience 4176

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

Density: 1.3±0.1 g/cm3
Boiling Point: 786.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 114.4±3.0 kJ/mol
Flash Point: 429.5±32.9 °C
Index of Refraction: 1.645
Molar Refractivity: 151.1±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 5.90
ACD/LogD (pH 5.5): 4.44
ACD/BCF (pH 5.5): 1355.04
ACD/KOC (pH 5.5): 5835.92
ACD/LogD (pH 7.4): 4.50
ACD/BCF (pH 7.4): 1556.49
ACD/KOC (pH 7.4): 6703.50
Polar Surface Area: 106 Å2
Polarizability: 59.9±0.5 10-24cm3
Surface Tension: 56.4±3.0 dyne/cm
Molar Volume: 416.7±3.0 cm3

Click to predict properties on the Chemicalize site


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