ChemSpider 2D Image | 1-{4-[4-Amino-7-(1-methyl-1H-pyrazol-4-yl)thieno[3,2-c]pyridin-3-yl]phenyl}-3-[4-(difluoromethoxy)phenyl]urea | C25H20F2N6O2S

1-{4-[4-Amino-7-(1-methyl-1H-pyrazol-4-yl)thieno[3,2-c]pyridin-3-yl]phenyl}-3-[4-(difluoromethoxy)phenyl]urea

  • Molecular FormulaC25H20F2N6O2S
  • Average mass506.527 Da
  • Monoisotopic mass506.133636 Da
  • ChemSpider ID24809085

More details:

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

1-{4-[4-Amino-7-(1-methyl-1H-pyrazol-4-yl)thieno[3,2-c]pyridin-3-yl]phenyl}-3-[4-(difluormethoxy)phenyl]harnstoff [German] [ACD/IUPAC Name]
1-{4-[4-Amino-7-(1-methyl-1H-pyrazol-4-yl)thieno[3,2-c]pyridin-3-yl]phenyl}-3-[4-(difluoromethoxy)phenyl]urea [ACD/IUPAC Name]
1-{4-[4-Amino-7-(1-méthyl-1H-pyrazol-4-yl)thiéno[3,2-c]pyridin-3-yl]phényl}-3-[4-(difluorométhoxy)phényl]urée [French] [ACD/IUPAC Name]
Urea, N-[4-[4-amino-7-(1-methyl-1H-pyrazol-4-yl)thieno[3,2-c]pyridin-3-yl]phenyl]-N'-[4-(difluoromethoxy)phenyl]- [ACD/Index Name]
Kinome_452

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

Density: 1.5±0.1 g/cm3
Boiling Point: 651.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.0±3.0 kJ/mol
Flash Point: 347.8±31.5 °C
Index of Refraction: 1.705
Molar Refractivity: 132.7±0.5 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 5.77
ACD/LogD (pH 5.5): 4.07
ACD/BCF (pH 5.5): 522.09
ACD/KOC (pH 5.5): 2066.25
ACD/LogD (pH 7.4): 4.66
ACD/BCF (pH 7.4): 2022.04
ACD/KOC (pH 7.4): 8002.45
Polar Surface Area: 135 Å2
Polarizability: 52.6±0.5 10-24cm3
Surface Tension: 55.7±7.0 dyne/cm
Molar Volume: 341.6±7.0 cm3

Click to predict properties on the Chemicalize site


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