ChemSpider 2D Image | 5-Bromo-2-{3-[4-(2-pyrimidinyl)-1-piperazinyl]-1-azetidinyl}pyrimidine | C15H18BrN7

5-Bromo-2-{3-[4-(2-pyrimidinyl)-1-piperazinyl]-1-azetidinyl}pyrimidine

  • Molecular FormulaC15H18BrN7
  • Average mass376.254 Da
  • Monoisotopic mass375.080688 Da
  • ChemSpider ID75469262

More details:

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

5-Brom-2-{3-[4-(2-pyrimidinyl)-1-piperazinyl]-1-azetidinyl}pyrimidin [German] [ACD/IUPAC Name]
5-Bromo-2-{3-[4-(2-pyrimidinyl)-1-piperazinyl]-1-azetidinyl}pyrimidine [ACD/IUPAC Name]
5-Bromo-2-{3-[4-(2-pyrimidinyl)-1-pipérazinyl]-1-azétidinyl}pyrimidine [French] [ACD/IUPAC Name]
Pyrimidine, 5-bromo-2-[3-[4-(2-pyrimidinyl)-1-piperazinyl]-1-azetidinyl]- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 566.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.1±3.0 kJ/mol
Flash Point: 296.5±32.9 °C
Index of Refraction: 1.667
Molar Refractivity: 90.0±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.53
ACD/LogD (pH 5.5): 1.87
ACD/BCF (pH 5.5): 13.97
ACD/KOC (pH 5.5): 204.29
ACD/LogD (pH 7.4): 2.04
ACD/BCF (pH 7.4): 21.01
ACD/KOC (pH 7.4): 307.18
Polar Surface Area: 61 Å2
Polarizability: 35.7±0.5 10-24cm3
Surface Tension: 74.1±3.0 dyne/cm
Molar Volume: 241.7±3.0 cm3

Click to predict properties on the Chemicalize site


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