ChemSpider 2D Image | 5-[7-{[4-(Methylsulfonyl)-1-piperazinyl]methyl}-2-(4-morpholinyl)thieno[3,2-d]pyrimidin-4-yl]-2-pyridinamine | C21H27N7O3S2

5-[7-{[4-(Methylsulfonyl)-1-piperazinyl]methyl}-2-(4-morpholinyl)thieno[3,2-d]pyrimidin-4-yl]-2-pyridinamine

  • Molecular FormulaC21H27N7O3S2
  • Average mass489.614 Da
  • Monoisotopic mass489.161682 Da
  • ChemSpider ID76729325

More details:






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

2-Pyridinamine, 5-[7-[[4-(methylsulfonyl)-1-piperazinyl]methyl]-2-(4-morpholinyl)thieno[3,2-d]pyrimidin-4-yl]- [ACD/Index Name]
5-[7-{[4-(Methylsulfonyl)-1-piperazinyl]methyl}-2-(4-morpholinyl)thieno[3,2-d]pyrimidin-4-yl]-2-pyridinamin [German] [ACD/IUPAC Name]
5-[7-{[4-(Methylsulfonyl)-1-piperazinyl]methyl}-2-(4-morpholinyl)thieno[3,2-d]pyrimidin-4-yl]-2-pyridinamine [ACD/IUPAC Name]
5-[7-{[4-(Méthylsulfonyl)-1-pipérazinyl]méthyl}-2-(4-morpholinyl)thiéno[3,2-d]pyrimidin-4-yl]-2-pyridinamine [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 736.7±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 107.5±3.0 kJ/mol
Flash Point: 399.3±35.7 °C
Index of Refraction: 1.724
Molar Refractivity: 128.6±0.4 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 1.44
ACD/LogD (pH 5.5): 1.33
ACD/BCF (pH 5.5): 5.66
ACD/KOC (pH 5.5): 112.18
ACD/LogD (pH 7.4): 1.43
ACD/BCF (pH 7.4): 7.21
ACD/KOC (pH 7.4): 142.95
Polar Surface Area: 154 Å2
Polarizability: 51.0±0.5 10-24cm3
Surface Tension: 90.2±5.0 dyne/cm
Molar Volume: 324.2±5.0 cm3

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