ChemSpider 2D Image | PF-06447475 | C17H15N5O

PF-06447475

  • Molecular FormulaC17H15N5O
  • Average mass305.334 Da
  • Monoisotopic mass305.127655 Da
  • ChemSpider ID34564997

More details:

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

1527473-33-1 [RN]
3-[4-(4-Morpholinyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]benzonitril [German] [ACD/IUPAC Name]
3-[4-(4-morpholinyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]-benzonitrile
3-[4-(4-Morpholinyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]benzonitrile [ACD/IUPAC Name]
3-[4-(4-Morpholinyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]benzonitrile [French] [ACD/IUPAC Name]
3-[4-(morpholin-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]benzonitrile
Benzonitrile, 3-[4-(4-morpholinyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]- [ACD/Index Name]
PF-06447475
[1527473-33-1] [RN]
3-(4-morpholin-4-yl-7H-pyrrolo[2,3-d]pyrimidin-5-yl)benzonitrile
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]
PubChem Substance ID 329825761 [DBID]
  • Experimental Physico-chemical Properties
  • Miscellaneous

    • Safety:

      Sold for research purposes under agreement from Pfizer Inc Tocris Bioscience 5716

    • Target Organs:

      LRRK2 inhibitor TargetMol T2050

    • Bio Activity:

      Enzymes Tocris Bioscience 5716
      Kinases Tocris Bioscience 5716
      LRRK2 Tocris Bioscience 5716
      LRRK2 MedChem Express HY-12477
      LRRK2 TargetMol T2050
      Neuronal Signaling; MedChem Express HY-12477
      Neuroscience TargetMol T2050
      PF-06447475 is a highly potent, selective, brain penetrant LRRK2 inhibitor with IC0 of 3 nM/11 nM for Wt LRRK2/G2019S LRRK2 respectively. MedChem Express
      PF-06447475 is a highly potent, selective, brain penetrant LRRK2 inhibitor with IC0 of 3 nM/11 nM for Wt LRRK2/G2019S LRRK2 respectively.;IC50 value: 3 nM/11 nM(Wt LRRK2/G2019S LRRK2);Target: LRRK2 inhibitorPF-06447475 was sufficiently potent in the LRRK2 whole cell assay (WCA; IC50=25 nM) (pS935 end point) to warrant additional profiling. Oral administration of PF-06447475 twice daily for 15 days was well tolerated at doses up to 60 mg kg-1 day-1 (31-fold Cave,0.24h; 70-fold Cmax) with only minimal alterations in RBC parameters, electrolytes, and food consumption without concurrent effects on body weight. MedChem Express HY-12477
      Potent LRRK2 inhibitor (IC50 = 3 nM). Attenuates ?-synuclein-induced dopaminergic neurodegeneration and neuroinflammation in G2019S-LRRK2 expressing rats. Also neuroprotective in wild type rats. Brain penetrant. Tocris Bioscience 5716
      Potent LRRK2 inhibitor (IC50 = 3 nM). Attenuates ?-synuclein-induced dopaminergic neurodegeneration and neuroinflammation in G2019S-LRRK2 expressing rats. Also neuroprotective in wild type rats. Brain penetrant. Tocris Bioscience 5716
      Potent LRRK2 inhibitor (IC50 = 3 nM). Attenuates alpha-synuclein-induced dopaminergic neurodegeneration and neuroinflammation in G2019S-LRRK2 expressing rats. Also neuroprotective in wild type rats. Brain penetrant. Tocris Bioscience 5716
      Potent LRRK2 inhibitor; neuroprotective Tocris Bioscience 5716

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: 1.711
Molar Refractivity: 85.2±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.00
ACD/LogD (pH 5.5): 1.58
ACD/BCF (pH 5.5): 6.83
ACD/KOC (pH 5.5): 94.79
ACD/LogD (pH 7.4): 2.14
ACD/BCF (pH 7.4): 24.57
ACD/KOC (pH 7.4): 340.96
Polar Surface Area: 78 Å2
Polarizability: 33.8±0.5 10-24cm3
Surface Tension: 83.4±5.0 dyne/cm
Molar Volume: 217.8±5.0 cm3

Click to predict properties on the Chemicalize site


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