ChemSpider 2D Image | Lck Inhibitor | C31H30N8O

Lck Inhibitor

  • Molecular FormulaC31H30N8O
  • Average mass530.623 Da
  • Monoisotopic mass530.254272 Da
  • ChemSpider ID9960558

More details:

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

6-(2,6-Dimethylphenyl)-2-{[4-(4-methyl-1-piperazinyl)phenyl]amino}pyrimido[5',4':5,6]pyrimido[1,2-a]benzimidazol-5(6H)-on [German] [ACD/IUPAC Name]
6-(2,6-Dimethylphenyl)-2-{[4-(4-methyl-1-piperazinyl)phenyl]amino}pyrimido[5',4':5,6]pyrimido[1,2-a]benzimidazol-5(6H)-one [ACD/IUPAC Name]
6-(2,6-Diméthylphényl)-2-{[4-(4-méthyl-1-pipérazinyl)phényl]amino}pyrimido[5',4':5,6]pyrimido[1,2-a]benzimidazol-5(6H)-one [French] [ACD/IUPAC Name]
6-(2,6-dimethylphenyl)-2-{[4-(4-methylpiperazin-1-yl)phenyl]amino}pyrimido[5',4':5,6]pyrimido[1,2-a]benzimidazol-5(6H)-one
847950-09-8 [RN]
Lck Inhibitor
Pyrimido[5',4':5,6]pyrimido[1,2-a]benzimidazol-5(6H)-one, 6-(2,6-dimethylphenyl)-2-[[4-(4-methyl-1-piperazinyl)phenyl]amino]- [ACD/Index Name]
[847950-09-8] [RN]
6-(2,6-dimethylphenyl)-2-((4-(4-methyl-1-piperazinyl)phenyl)amino)pyrimido-[5',4':5,6]pyrimido[1,2-a]benzimidazol-5(6H)-one
6-(2,6-dimethylphenyl)-2-((4-(4-methylpiperazin-1-yl)phenyl)amino)benzo[4,5]imidazo[1,2-a]pyrimido[5,4-e]pyrimidin-5(6H)-one
More...

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

CCRIS 4693 [DBID]
  • Experimental Physico-chemical Properties
  • Miscellaneous

    • Bio Activity:

      Enzymes Tocris Bioscience 3567
      Kinases Tocris Bioscience 3567
      Lck Inhibitor is a new class of compounds that are potent inhibitors of Lck with an IC50 value of 7 nM. MedChem Express
      Lck Inhibitor is a new class of compounds that are potent inhibitors of Lck with an IC50 value of 7 nM.; IC50 Value: 7 nM [1]; Target: Lck; in vitro: Lck Inhibitor (compound 25) exhibited good potency in the T-cell receptor-induced IL-2 secretion assay (IL- 2) and also inhibited subsequent T-cell proliferation (T-cell prolif.) in the same human T -cells.; in vivo: A once daily dose of 25was administered orally at 10, 30, and 60 mg/kg from day 9 today 17. MedChem Express HY-12072
      Potent inhibitor of lymphocyte specific kinase (Lck). IC50 values are 0.007, 0.021, 0.042 and 0.20 ?M for Lck, Lyn, Src and Syk kinases respectively. Displays >1000-fold selectivity for Lck over MAPK, CDK and RSK family representatives. Inhibits T cell proliferation in vitro and inhibits arthritis in two in vivo models. Orally active. Tocris Bioscience 3567
      Potent inhibitor of lymphocyte specific kinase (Lck). IC50 values are 0.007, 0.021, 0.042 and 0.20 ?M for Lck, Lyn, Src and Syk kinases respectively. Displays >1000-fold selectivity for Lck over MAPK, CDK and RSK family representatives. Inhibits T cell proliferation in vitro and inhibits arthritis in two in vivo models. Orally active. Tocris Bioscience 3567
      Potent inhibitor of lymphocyte specific kinase (Lck). IC50 values are 0.007, 0.021, 0.042 and 0.20 muM for Lck, Lyn, Src and Syk kinases respectively. Displays >1000-fold selectivity for Lck over MAPK, CDK and RSK family representatives. Inhibits T cell proliferation in vitro and inhibits arthritis in two in vivo models. Orally active. Tocris Bioscience 3567
      Potent Lck inhibitor Tocris Bioscience 3567
      Protein Tyrosine Kinase/RTK MedChem Express HY-12072
      Protein Tyrosine Kinase/RTK; MedChem Express HY-12072
      Src MedChem Express HY-12072
      Src Family Kinases Tocris Bioscience 3567
      Src Kinases Tocris Bioscience 3567

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

Density: 1.4±0.1 g/cm3
Boiling Point: 809.1±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 117.6±3.0 kJ/mol
Flash Point: 443.1±37.1 °C
Index of Refraction: 1.737
Molar Refractivity: 155.9±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: 5.33
ACD/LogD (pH 5.5): 2.36
ACD/BCF (pH 5.5): 10.91
ACD/KOC (pH 5.5): 46.47
ACD/LogD (pH 7.4): 4.03
ACD/BCF (pH 7.4): 517.84
ACD/KOC (pH 7.4): 2204.85
Polar Surface Area: 82 Å2
Polarizability: 61.8±0.5 10-24cm3
Surface Tension: 57.1±7.0 dyne/cm
Molar Volume: 387.9±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement