ChemSpider 2D Image | 1-(4-{4-morpholin-4-yl-1-[1-(pyridin-3-ylcarbonyl)piperidin-4-yl]-1H-pyrazolo[3,4-D]pyrimidin-6-yl}phenyl)-3-pyridin-4-ylurea | C32H32N10O3

1-(4-{4-morpholin-4-yl-1-[1-(pyridin-3-ylcarbonyl)piperidin-4-yl]-1H-pyrazolo[3,4-D]pyrimidin-6-yl}phenyl)-3-pyridin-4-ylurea

  • Molecular FormulaC32H32N10O3
  • Average mass604.662 Da
  • Monoisotopic mass604.265869 Da
  • ChemSpider ID24613592

More details:






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

1-(4-{4-(4-Morpholinyl)-1-[1-(3-pyridinylcarbonyl)-4-piperidinyl]-1H-pyrazolo[3,4-d]pyrimidin-6-yl}phenyl)-3-(4-pyridinyl)harnstoff [German] [ACD/IUPAC Name]
1-(4-{4-(4-Morpholinyl)-1-[1-(3-pyridinylcarbonyl)-4-piperidinyl]-1H-pyrazolo[3,4-d]pyrimidin-6-yl}phenyl)-3-(4-pyridinyl)urea [ACD/IUPAC Name]
1-(4-{4-(4-Morpholinyl)-1-[1-(3-pyridinylcarbonyl)-4-pipéridinyl]-1H-pyrazolo[3,4-d]pyrimidin-6-yl}phényl)-3-(4-pyridinyl)urée [French] [ACD/IUPAC Name]
1-(4-{4-morpholin-4-yl-1-[1-(pyridin-3-ylcarbonyl)piperidin-4-yl]-1H-pyrazolo[3,4-D]pyrimidin-6-yl}phenyl)-3-pyridin-4-ylurea
Urea, N-[4-[4-(4-morpholinyl)-1-[1-(3-pyridinylcarbonyl)-4-piperidinyl]-1H-pyrazolo[3,4-d]pyrimidin-6-yl]phenyl]-N'-4-pyridinyl- [ACD/Index Name]
L64
N-methyl-N'-(4-{4-morpholin-4-yl-1-[1-(pyridin-3-ylcarbonyl)piperidin-4-yl]-1Hpyrazolo[3,4-d]pyrimidin-6-yl}phenyl)urea
pyrazolo pyrimidine, 26

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 725.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 105.9±3.0 kJ/mol
Flash Point: 392.3±32.9 °C
Index of Refraction: 1.751
Molar Refractivity: 168.5±0.5 cm3
#H bond acceptors: 13
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 0.95
ACD/LogD (pH 5.5): 1.24
ACD/BCF (pH 5.5): 3.53
ACD/KOC (pH 5.5): 54.86
ACD/LogD (pH 7.4): 1.90
ACD/BCF (pH 7.4): 16.28
ACD/KOC (pH 7.4): 253.01
Polar Surface Area: 143 Å2
Polarizability: 66.8±0.5 10-24cm3
Surface Tension: 65.9±7.0 dyne/cm
Molar Volume: 413.4±7.0 cm3

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