ChemSpider 2D Image | 2-(4-Fluorophenyl)-N-(2-{4-[4-(2-pyrimidinyl)-1-piperazinyl]-1H-pyrazolo[3,4-d]pyrimidin-1-yl}ethyl)acetamide | C23H24FN9O

2-(4-Fluorophenyl)-N-(2-{4-[4-(2-pyrimidinyl)-1-piperazinyl]-1H-pyrazolo[3,4-d]pyrimidin-1-yl}ethyl)acetamide

  • Molecular FormulaC23H24FN9O
  • Average mass461.495 Da
  • Monoisotopic mass461.208771 Da
  • ChemSpider ID21928963

More details:

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

2-(4-Fluorophenyl)-N-(2-{4-[4-(2-pyrimidinyl)-1-piperazinyl]-1H-pyrazolo[3,4-d]pyrimidin-1-yl}ethyl)acetamide [ACD/IUPAC Name]
2-(4-Fluorophényl)-N-(2-{4-[4-(2-pyrimidinyl)-1-pipérazinyl]-1H-pyrazolo[3,4-d]pyrimidin-1-yl}éthyl)acétamide [French] [ACD/IUPAC Name]
2-(4-Fluorphenyl)-N-(2-{4-[4-(2-pyrimidinyl)-1-piperazinyl]-1H-pyrazolo[3,4-d]pyrimidin-1-yl}ethyl)acetamid [German] [ACD/IUPAC Name]
Benzeneacetamide, 4-fluoro-N-[2-[4-[4-(2-pyrimidinyl)-1-piperazinyl]-1H-pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]- [ACD/Index Name]
1021025-62-6 [RN]
2-(4-fluorophenyl)-N-(2-(4-(4-(pyrimidin-2-yl)piperazin-1-yl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl)acetamide
2-(4-fluorophenyl)-N-(2-{4-[4-(pyrimidin-2-yl)piperazin-1-yl]-1H-pyrazolo[3,4-d]pyrimidin-1-yl}ethyl)acetamide

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.720
Molar Refractivity: 126.7±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 0.75
ACD/LogD (pH 5.5): 1.46
ACD/BCF (pH 5.5): 6.75
ACD/KOC (pH 5.5): 118.17
ACD/LogD (pH 7.4): 1.68
ACD/BCF (pH 7.4): 11.11
ACD/KOC (pH 7.4): 194.59
Polar Surface Area: 105 Å2
Polarizability: 50.2±0.5 10-24cm3
Surface Tension: 60.7±7.0 dyne/cm
Molar Volume: 320.7±7.0 cm3

Click to predict properties on the Chemicalize site


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