ChemSpider 2D Image | 2-{[2-({5-[(N,N-Dimethylglycyl)amino]-2-methoxy-4-methylphenyl}amino)-1H-pyrrolo[2,3-d]pyrimidin-4-yl]amino}-6-fluorobenzamide | C25H27FN8O3

2-{[2-({5-[(N,N-Dimethylglycyl)amino]-2-methoxy-4-methylphenyl}amino)-1H-pyrrolo[2,3-d]pyrimidin-4-yl]amino}-6-fluorobenzamide

  • Molecular FormulaC25H27FN8O3
  • Average mass506.532 Da
  • Monoisotopic mass506.219025 Da
  • ChemSpider ID24714489

More details:

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

2-{[2-({5-[(N,N-Dimethylglycyl)amino]-2-methoxy-4-methylphenyl}amino)-1H-pyrrolo[2,3-d]pyrimidin-4-yl]amino}-6-fluorbenzamid [German] [ACD/IUPAC Name]
2-{[2-({5-[(N,N-Dimethylglycyl)amino]-2-methoxy-4-methylphenyl}amino)-1H-pyrrolo[2,3-d]pyrimidin-4-yl]amino}-6-fluorobenzamide [ACD/IUPAC Name]
2-{[2-({5-[(N,N-Diméthylglycyl)amino]-2-méthoxy-4-méthylphényl}amino)-1H-pyrrolo[2,3-d]pyrimidin-4-yl]amino}-6-fluorobenzamide [French] [ACD/IUPAC Name]
Benzamide, 2-[[2-[[5-[[2-(dimethylamino)acetyl]amino]-2-methoxy-4-methylphenyl]amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino]-6-fluoro- [ACD/Index Name]
GSK2213727A
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL511765/

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: 1.721
Molar Refractivity: 141.1±0.3 cm3
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 3
ACD/LogP: 1.30
ACD/LogD (pH 5.5): -0.80
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 2.10
ACD/BCF (pH 7.4): 18.54
ACD/KOC (pH 7.4): 217.40
Polar Surface Area: 150 Å2
Polarizability: 56.0±0.5 10-24cm3
Surface Tension: 69.5±3.0 dyne/cm
Molar Volume: 356.9±3.0 cm3

Click to predict properties on the Chemicalize site


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