ChemSpider 2D Image | compound 15b [PMID: 18334293] | C20H20ClN5

compound 15b [PMID: 18334293]

  • Molecular FormulaC20H20ClN5
  • Average mass365.859 Da
  • Monoisotopic mass365.140717 Da
  • ChemSpider ID23321249

More details:

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

2-Pyrimidinamine, N-(3-chlorophenyl)-4-[3-(1-piperazinyl)phenyl]- [ACD/Index Name]
compound 15b [PMID: 18334293]
N-(3-Chlorophenyl)-4-[3-(1-piperazinyl)phenyl]-2-pyrimidinamine [ACD/IUPAC Name]
N-(3-Chlorophényl)-4-[3-(1-pipérazinyl)phényl]-2-pyrimidinamine [French] [ACD/IUPAC Name]
N-(3-chlorophenyl)-4-[3-(piperazin-1-yl)phenyl]pyrimidin-2-amine
N-(3-Chlorphenyl)-4-[3-(1-piperazinyl)phenyl]-2-pyrimidinamin [German] [ACD/IUPAC Name]
compound 15b [PMID 18334293]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL270849/
N-(3-chlorophenyl)-4-(3-(piperazin-1-yl)phenyl)pyrimidin-2-amine
Scios-15b

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

Density: 1.3±0.1 g/cm3
Boiling Point: 613.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.0±3.0 kJ/mol
Flash Point: 324.7±34.3 °C
Index of Refraction: 1.650
Molar Refractivity: 104.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.60
ACD/LogD (pH 5.5): 1.45
ACD/BCF (pH 5.5): 1.61
ACD/KOC (pH 5.5): 7.97
ACD/LogD (pH 7.4): 3.05
ACD/BCF (pH 7.4): 64.18
ACD/KOC (pH 7.4): 317.73
Polar Surface Area: 53 Å2
Polarizability: 41.6±0.5 10-24cm3
Surface Tension: 56.9±3.0 dyne/cm
Molar Volume: 287.5±3.0 cm3

Click to predict properties on the Chemicalize site


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