ChemSpider 2D Image | 1-(4-{4-Amino-7-[1-(2-hydroxyethyl)-1H-pyrazol-4-yl]thieno[3,2-c]pyridin-3-yl}phenyl)-3-(4-methoxyphenyl)urea | C26H24N6O3S

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

  • Molecular FormulaC26H24N6O3S
  • Average mass500.572 Da
  • Monoisotopic mass500.163055 Da
  • ChemSpider ID24809074

More details:

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

1-(4-{4-Amino-7-[1-(2-hydroxyethyl)-1H-pyrazol-4-yl]thieno[3,2-c]pyridin-3-yl}phenyl)-3-(4-methoxyphenyl)harnstoff [German] [ACD/IUPAC Name]
1-(4-{4-Amino-7-[1-(2-hydroxyethyl)-1H-pyrazol-4-yl]thieno[3,2-c]pyridin-3-yl}phenyl)-3-(4-methoxyphenyl)urea [ACD/IUPAC Name]
1-(4-{4-Amino-7-[1-(2-hydroxyéthyl)-1H-pyrazol-4-yl]thiéno[3,2-c]pyridin-3-yl}phényl)-3-(4-méthoxyphényl)urée [French] [ACD/IUPAC Name]
Urea, N-[4-[4-amino-7-[1-(2-hydroxyethyl)-1H-pyrazol-4-yl]thieno[3,2-c]pyridin-3-yl]phenyl]-N'-(4-methoxyphenyl)- [ACD/Index Name]
Kinome_491

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

Density: 1.4±0.1 g/cm3
Boiling Point: 705.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 108.4±3.0 kJ/mol
Flash Point: 380.3±32.9 °C
Index of Refraction: 1.724
Molar Refractivity: 138.4±0.5 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 4.96
ACD/LogD (pH 5.5): 3.19
ACD/BCF (pH 5.5): 111.66
ACD/KOC (pH 5.5): 685.98
ACD/LogD (pH 7.4): 3.77
ACD/BCF (pH 7.4): 430.46
ACD/KOC (pH 7.4): 2644.54
Polar Surface Area: 156 Å2
Polarizability: 54.9±0.5 10-24cm3
Surface Tension: 61.3±7.0 dyne/cm
Molar Volume: 349.1±7.0 cm3

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