ChemSpider 2D Image | 1-{4-[4-Amino-7-(6-methyl-3-pyridinyl)thieno[3,2-c]pyridin-3-yl]phenyl}-3-(3-fluorophenyl)urea | C26H20FN5OS

1-{4-[4-Amino-7-(6-methyl-3-pyridinyl)thieno[3,2-c]pyridin-3-yl]phenyl}-3-(3-fluorophenyl)urea

  • Molecular FormulaC26H20FN5OS
  • Average mass469.533 Da
  • Monoisotopic mass469.137268 Da
  • ChemSpider ID24809089

More details:

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

1-{4-[4-Amino-7-(6-methyl-3-pyridinyl)thieno[3,2-c]pyridin-3-yl]phenyl}-3-(3-fluorophenyl)urea [ACD/IUPAC Name]
1-{4-[4-Amino-7-(6-méthyl-3-pyridinyl)thiéno[3,2-c]pyridin-3-yl]phényl}-3-(3-fluorophényl)urée [French] [ACD/IUPAC Name]
1-{4-[4-Amino-7-(6-methyl-3-pyridinyl)thieno[3,2-c]pyridin-3-yl]phenyl}-3-(3-fluorphenyl)harnstoff [German] [ACD/IUPAC Name]
Urea, N-[4-[4-amino-7-(6-methyl-3-pyridinyl)thieno[3,2-c]pyridin-3-yl]phenyl]-N'-(3-fluorophenyl)- [ACD/Index Name]
Kinome_436

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

Density: 1.4±0.1 g/cm3
Boiling Point: 614.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.2±3.0 kJ/mol
Flash Point: 325.5±31.5 °C
Index of Refraction: 1.750
Molar Refractivity: 135.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 7.12
ACD/LogD (pH 5.5): 5.02
ACD/BCF (pH 5.5): 3145.07
ACD/KOC (pH 5.5): 8722.85
ACD/LogD (pH 7.4): 5.38
ACD/BCF (pH 7.4): 7214.55
ACD/KOC (pH 7.4): 20009.56
Polar Surface Area: 121 Å2
Polarizability: 53.8±0.5 10-24cm3
Surface Tension: 68.3±3.0 dyne/cm
Molar Volume: 333.2±3.0 cm3

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