ChemSpider 2D Image | CGI1746 | C34H37N5O4

CGI1746

  • Molecular FormulaC34H37N5O4
  • Average mass579.689 Da
  • Monoisotopic mass579.284546 Da
  • ChemSpider ID24750818

More details:

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

4-(tert-Butyl)-N-(2-methyl-3-(4-methyl-6-((4-(morpholine-4-carbonyl)phenyl)amino)-5-oxo-4,5-dihydropyrazin-2-yl)phenyl)benzamide
4-tert-butyl-N-[2-methyl-3-(4-methyl-6-{[4-(morpholine-4-carbonyl)phenyl]amino}-5-oxo-4,5-dihydropyrazin-2-yl)phenyl]benzamide
4-TERT-BUTYL-N-[2-METHYL-3-(4-METHYL-6-{[4-(MORPHOLINE-4-CARBONYL)PHENYL]AMINO}-5-OXOPYRAZIN-2-YL)PHENYL]BENZAMIDE
910232-84-7 [RN]
Benzamide, N-[3-[4,5-dihydro-4-methyl-6-[[4-(4-morpholinylcarbonyl)phenyl]amino]-5-oxo-2-pyrazinyl]-2-methylphenyl]-4-(1,1-dimethylethyl)- [ACD/Index Name]
CGI1746
CGI-1746
N-[2-Methyl-3-(4-methyl-6-{[4-(4-morpholinylcarbonyl)phenyl]amino}-5-oxo-4,5-dihydro-2-pyrazinyl)phenyl]-4-(2-methyl-2-propanyl)benzamid [German] [ACD/IUPAC Name]
N-[2-Methyl-3-(4-methyl-6-{[4-(4-morpholinylcarbonyl)phenyl]amino}-5-oxo-4,5-dihydro-2-pyrazinyl)phenyl]-4-(2-methyl-2-propanyl)benzamide [ACD/IUPAC Name]
N-[2-Méthyl-3-(4-méthyl-6-{[4-(4-morpholinylcarbonyl)phényl]amino}-5-oxo-4,5-dihydro-2-pyrazinyl)phényl]-4-(2-méthyl-2-propanyl)benzamide [French] [ACD/IUPAC Name]
More...

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

746 [DBID]
  • Experimental Physico-chemical Properties
  • Miscellaneous

    • Target Organs:

      BTK inhibitor TargetMol T2472

    • Bio Activity:

      Angiogenesis TargetMol T2472
      Btk MedChem Express HY-11999
      BTK TargetMol T2472
      CGI-1746 is a small-molecule Bruton's tyrosine kinase (Btk) inhibitor. MedChem Express
      CGI-1746 is a small-molecule Bruton's tyrosine kinase (Btk) inhibitor.; IC50 value: ; Target: Btk; CGI-1746 has exquisite selectivity for Btk and inhibits both auto- and transphosphorylation steps necessary for enzyme activation. MedChem Express HY-11999
      CGI-1746 is a small-molecule Bruton's tyrosine kinase (Btk) inhibitor.;IC50 value: ;Target: BtkCGI-1746 has exquisite selectivity for Btk and inhibits both auto- and transphosphorylation steps necessary for enzyme activation. CGI-1746 is useful for heumatoid Arthritis MedChem Express HY-11999
      Protein Tyrosine Kinase/RTK MedChem Express HY-11999
      Protein Tyrosine Kinase/RTK; MedChem Express HY-11999

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.627
Molar Refractivity: 167.1±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 3.42
ACD/LogD (pH 5.5): 3.42
ACD/BCF (pH 5.5): 235.45
ACD/KOC (pH 5.5): 1735.44
ACD/LogD (pH 7.4): 3.42
ACD/BCF (pH 7.4): 235.46
ACD/KOC (pH 7.4): 1735.52
Polar Surface Area: 103 Å2
Polarizability: 66.3±0.5 10-24cm3
Surface Tension: 47.0±7.0 dyne/cm
Molar Volume: 471.4±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement