ChemSpider 2D Image | 5-(3-Methyl-1,2-oxazol-5-yl)-2-(4-methyl-1-piperazinyl)-4-[1-(4-methyl-2-pyrimidinyl)-3-piperidinyl]pyrimidine | C23H30N8O

5-(3-Methyl-1,2-oxazol-5-yl)-2-(4-methyl-1-piperazinyl)-4-[1-(4-methyl-2-pyrimidinyl)-3-piperidinyl]pyrimidine

  • Molecular FormulaC23H30N8O
  • Average mass434.537 Da
  • Monoisotopic mass434.254272 Da
  • ChemSpider ID29871466

More details:

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

5-(3-Methyl-1,2-oxazol-5-yl)-2-(4-methyl-1-piperazinyl)-4-[1-(4-methyl-2-pyrimidinyl)-3-piperidinyl]pyrimidin [German] [ACD/IUPAC Name]
5-(3-Methyl-1,2-oxazol-5-yl)-2-(4-methyl-1-piperazinyl)-4-[1-(4-methyl-2-pyrimidinyl)-3-piperidinyl]pyrimidine [ACD/IUPAC Name]
5-(3-Méthyl-1,2-oxazol-5-yl)-2-(4-méthyl-1-pipérazinyl)-4-[1-(4-méthyl-2-pyrimidinyl)-3-pipéridinyl]pyrimidine [French] [ACD/IUPAC Name]
Pyrimidine, 5-(3-methyl-5-isoxazolyl)-2-(4-methyl-1-piperazinyl)-4-[1-(4-methyl-2-pyrimidinyl)-3-piperidinyl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 663.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.6±3.0 kJ/mol
Flash Point: 355.2±34.3 °C
Index of Refraction: 1.595
Molar Refractivity: 121.0±0.3 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.71
ACD/LogD (pH 5.5): 1.36
ACD/BCF (pH 5.5): 2.29
ACD/KOC (pH 5.5): 18.79
ACD/LogD (pH 7.4): 3.09
ACD/BCF (pH 7.4): 122.80
ACD/KOC (pH 7.4): 1009.70
Polar Surface Area: 87 Å2
Polarizability: 48.0±0.5 10-24cm3
Surface Tension: 56.5±3.0 dyne/cm
Molar Volume: 356.0±3.0 cm3

Click to predict properties on the Chemicalize site


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