ChemSpider 2D Image | [3-(6-{[4-(Methylsulfonyl)piperazin-1-Yl]methyl}-4-Morpholin-4-Ylthieno[3,2-D]pyrimidin-2-Yl)phenyl]methanol | C23H29N5O4S2

[3-(6-{[4-(Methylsulfonyl)piperazin-1-Yl]methyl}-4-Morpholin-4-Ylthieno[3,2-D]pyrimidin-2-Yl)phenyl]methanol

  • Molecular FormulaC23H29N5O4S2
  • Average mass503.638 Da
  • Monoisotopic mass503.166107 Da
  • ChemSpider ID24661754

More details:

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

[3-(6-{[4-(Methylsulfonyl)piperazin-1-Yl]methyl}-4-Morpholin-4-Ylthieno[3,2-D]pyrimidin-2-Yl)phenyl]methanol
{3-[6-{[4-(Methylsulfonyl)-1-piperazinyl]methyl}-4-(4-morpholinyl)thieno[3,2-d]pyrimidin-2-yl]phenyl}methanol [German] [ACD/IUPAC Name]
{3-[6-{[4-(Methylsulfonyl)-1-piperazinyl]methyl}-4-(4-morpholinyl)thieno[3,2-d]pyrimidin-2-yl]phenyl}methanol [ACD/IUPAC Name]
{3-[6-{[4-(Méthylsulfonyl)-1-pipérazinyl]méthyl}-4-(4-morpholinyl)thiéno[3,2-d]pyrimidin-2-yl]phényl}méthanol [French] [ACD/IUPAC Name]
3-[6-[[4-(Methylsulfonyl)-1-piperazinyl]methyl]-4-(4-morpholinyl)thieno[3,2-d]pyrimidin-2-yl]benzenemethanol
956032-81-8 [RN]
Benzenemethanol, 3-[6-[[4-(methylsulfonyl)-1-piperazinyl]methyl]-4-(4-morpholinyl)thieno[3,2-d]pyrimidin-2-yl]- [ACD/Index Name]
JZW

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

Density: 1.5±0.1 g/cm3
Boiling Point: 655.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 101.5±3.0 kJ/mol
Flash Point: 350.4±34.3 °C
Index of Refraction: 1.710
Molar Refractivity: 133.3±0.4 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 1.26
ACD/LogD (pH 5.5): 1.35
ACD/BCF (pH 5.5): 5.74
ACD/KOC (pH 5.5): 109.69
ACD/LogD (pH 7.4): 1.51
ACD/BCF (pH 7.4): 8.21
ACD/KOC (pH 7.4): 156.79
Polar Surface Area: 136 Å2
Polarizability: 52.9±0.5 10-24cm3
Surface Tension: 83.3±5.0 dyne/cm
Molar Volume: 341.2±5.0 cm3

Click to predict properties on the Chemicalize site


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