ChemSpider 2D Image | 3-{1-[6-(Dimethylamino)-4-pyrimidinyl]-3,5-dimethyl-1H-pyrazol-4-yl}-1-[4-(2-pyridinyl)-1-piperazinyl]-1-propanone | C23H30N8O

3-{1-[6-(Dimethylamino)-4-pyrimidinyl]-3,5-dimethyl-1H-pyrazol-4-yl}-1-[4-(2-pyridinyl)-1-piperazinyl]-1-propanone

  • Molecular FormulaC23H30N8O
  • Average mass434.537 Da
  • Monoisotopic mass434.254272 Da
  • ChemSpider ID28955864

More details:

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

1-Propanone, 3-[1-[6-(dimethylamino)-4-pyrimidinyl]-3,5-dimethyl-1H-pyrazol-4-yl]-1-[4-(2-pyridinyl)-1-piperazinyl]- [ACD/Index Name]
3-{1-[6-(Dimethylamino)-4-pyrimidinyl]-3,5-dimethyl-1H-pyrazol-4-yl}-1-[4-(2-pyridinyl)-1-piperazinyl]-1-propanon [German] [ACD/IUPAC Name]
3-{1-[6-(Dimethylamino)-4-pyrimidinyl]-3,5-dimethyl-1H-pyrazol-4-yl}-1-[4-(2-pyridinyl)-1-piperazinyl]-1-propanone [ACD/IUPAC Name]
3-{1-[6-(Diméthylamino)-4-pyrimidinyl]-3,5-diméthyl-1H-pyrazol-4-yl}-1-[4-(2-pyridinyl)-1-pipérazinyl]-1-propanone [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 692.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.5±3.0 kJ/mol
Flash Point: 372.9±31.5 °C
Index of Refraction: 1.656
Molar Refractivity: 126.5±0.5 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.41
ACD/LogD (pH 5.5): 0.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.36
ACD/LogD (pH 7.4): 1.46
ACD/BCF (pH 7.4): 4.14
ACD/KOC (pH 7.4): 47.58
Polar Surface Area: 83 Å2
Polarizability: 50.2±0.5 10-24cm3
Surface Tension: 49.7±7.0 dyne/cm
Molar Volume: 344.3±7.0 cm3

Click to predict properties on the Chemicalize site


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