ChemSpider 2D Image | 2-(4-{[2-Methoxy-5-(2-methyl-2-propanyl)phenyl]sulfonyl}-1-piperazinyl)-N-(4-methoxyphenyl)-6-methyl-4-pyrimidinamine | C27H35N5O4S

2-(4-{[2-Methoxy-5-(2-methyl-2-propanyl)phenyl]sulfonyl}-1-piperazinyl)-N-(4-methoxyphenyl)-6-methyl-4-pyrimidinamine

  • Molecular FormulaC27H35N5O4S
  • Average mass525.663 Da
  • Monoisotopic mass525.240967 Da
  • ChemSpider ID21079638

More details:

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

2-(4-{[2-Methoxy-5-(2-methyl-2-propanyl)phenyl]sulfonyl}-1-piperazinyl)-N-(4-methoxyphenyl)-6-methyl-4-pyrimidinamin [German] [ACD/IUPAC Name]
2-(4-{[2-Methoxy-5-(2-methyl-2-propanyl)phenyl]sulfonyl}-1-piperazinyl)-N-(4-methoxyphenyl)-6-methyl-4-pyrimidinamine [ACD/IUPAC Name]
2-(4-{[2-Méthoxy-5-(2-méthyl-2-propanyl)phényl]sulfonyl}-1-pipérazinyl)-N-(4-méthoxyphényl)-6-méthyl-4-pyrimidinamine [French] [ACD/IUPAC Name]
4-Pyrimidinamine, 2-[4-[[5-(1,1-dimethylethyl)-2-methoxyphenyl]sulfonyl]-1-piperazinyl]-N-(4-methoxyphenyl)-6-methyl- [ACD/Index Name]
2-(4-((5-(tert-butyl)-2-methoxyphenyl)sulfonyl)piperazin-1-yl)-N-(4-methoxyphenyl)-6-methylpyrimidin-4-amine
2-[4-(5-tert-butyl-2-methoxybenzenesulfonyl)piperazin-1-yl]-N-(4-methoxyphenyl)-6-methylpyrimidin-4-amine
2-{4-[(5-tert-butyl-2-methoxyphenyl)sulfonyl]piperazin-1-yl}-N-(4-methoxyphenyl)-6-methylpyrimidin-4-amine
946364-75-6 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 714.4±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.4±3.0 kJ/mol
Flash Point: 385.9±35.7 °C
Index of Refraction: 1.597
Molar Refractivity: 144.4±0.4 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 6.51
ACD/LogD (pH 5.5): 3.36
ACD/BCF (pH 5.5): 58.78
ACD/KOC (pH 5.5): 140.62
ACD/LogD (pH 7.4): 4.75
ACD/BCF (pH 7.4): 1432.42
ACD/KOC (pH 7.4): 3426.80
Polar Surface Area: 105 Å2
Polarizability: 57.2±0.5 10-24cm3
Surface Tension: 52.9±3.0 dyne/cm
Molar Volume: 423.5±3.0 cm3

Click to predict properties on the Chemicalize site


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