ChemSpider 2D Image | 4-(5-Chloro-3-isopropyl-1H-pyrazol-4-yl)-N-[5-(1-piperazinyl)-2-pyridinyl]-2-pyrimidinamine | C19H23ClN8

4-(5-Chloro-3-isopropyl-1H-pyrazol-4-yl)-N-[5-(1-piperazinyl)-2-pyridinyl]-2-pyrimidinamine

  • Molecular FormulaC19H23ClN8
  • Average mass398.892 Da
  • Monoisotopic mass398.173431 Da
  • ChemSpider ID25060639

More details:

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

2-Pyrimidinamine, 4-[5-chloro-3-(1-methylethyl)-1H-pyrazol-4-yl]-N-[5-(1-piperazinyl)-2-pyridinyl]- [ACD/Index Name]
4-(5-Chlor-3-isopropyl-1H-pyrazol-4-yl)-N-[5-(1-piperazinyl)-2-pyridinyl]-2-pyrimidinamin [German] [ACD/IUPAC Name]
4-(5-Chloro-3-isopropyl-1H-pyrazol-4-yl)-N-[5-(1-piperazinyl)-2-pyridinyl]-2-pyrimidinamine [ACD/IUPAC Name]
4-(5-Chloro-3-isopropyl-1H-pyrazol-4-yl)-N-[5-(1-pipérazinyl)-2-pyridinyl]-2-pyrimidinamine [French] [ACD/IUPAC Name]
4-[5-Chloro-3-(1-Methylethyl)-1h-Pyrazol-4-Yl]-N-(5-Piperazin-1-Ylpyridin-2-Yl)pyrimidin-2-Amine
3NV

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

Density: 1.3±0.1 g/cm3
Boiling Point: 689.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 101.0±3.0 kJ/mol
Flash Point: 370.5±34.3 °C
Index of Refraction: 1.645
Molar Refractivity: 109.7±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.20
ACD/LogD (pH 5.5): -0.34
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.12
ACD/BCF (pH 7.4): 1.85
ACD/KOC (pH 7.4): 20.37
Polar Surface Area: 95 Å2
Polarizability: 43.5±0.5 10-24cm3
Surface Tension: 65.0±3.0 dyne/cm
Molar Volume: 302.3±3.0 cm3

Click to predict properties on the Chemicalize site


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