ChemSpider 2D Image | N-[3-(2,5-Dimethylphenyl)-1-phenyl-1H-pyrazol-5-yl]-2-[(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]acetamide | C25H23N7OS

N-[3-(2,5-Dimethylphenyl)-1-phenyl-1H-pyrazol-5-yl]-2-[(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]acetamide

  • Molecular FormulaC25H23N7OS
  • Average mass469.561 Da
  • Monoisotopic mass469.168488 Da
  • ChemSpider ID31564456

More details:

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

Acetamide, N-[3-(2,5-dimethylphenyl)-1-phenyl-1H-pyrazol-5-yl]-2-[(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)thio]- [ACD/Index Name]
N-[3-(2,5-Dimethylphenyl)-1-phenyl-1H-pyrazol-5-yl]-2-[(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]acetamid [German] [ACD/IUPAC Name]
N-[3-(2,5-Dimethylphenyl)-1-phenyl-1H-pyrazol-5-yl]-2-[(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]acetamide [ACD/IUPAC Name]
N-[3-(2,5-Diméthylphényl)-1-phényl-1H-pyrazol-5-yl]-2-[(1-méthyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]acétamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 713.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.3±3.0 kJ/mol
Flash Point: 385.4±32.9 °C
Index of Refraction: 1.717
Molar Refractivity: 136.3±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.93
ACD/LogD (pH 5.5): 3.94
ACD/BCF (pH 5.5): 576.82
ACD/KOC (pH 5.5): 3295.43
ACD/LogD (pH 7.4): 3.94
ACD/BCF (pH 7.4): 577.02
ACD/KOC (pH 7.4): 3296.54
Polar Surface Area: 116 Å2
Polarizability: 54.0±0.5 10-24cm3
Surface Tension: 55.5±7.0 dyne/cm
Molar Volume: 346.3±7.0 cm3

Click to predict properties on the Chemicalize site


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