ChemSpider 2D Image | 4-(Cyclohexylamino)pyrido[3,4-d]pyrimidin-8(7H)-one | C13H16N4O

4-(Cyclohexylamino)pyrido[3,4-d]pyrimidin-8(7H)-one

  • Molecular FormulaC13H16N4O
  • Average mass244.292 Da
  • Monoisotopic mass244.132416 Da
  • ChemSpider ID30835507

More details:






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

4-(Cyclohexylamino)pyrido[3,4-d]pyrimidin-8(7H)-on [German] [ACD/IUPAC Name]
4-(Cyclohexylamino)pyrido[3,4-d]pyrimidin-8(7H)-one [ACD/IUPAC Name]
4-(Cyclohexylamino)pyrido[3,4-d]pyrimidin-8(7H)-one [French] [ACD/IUPAC Name]
Pyrido[3,4-d]pyrimidin-8(7H)-one, 4-(cyclohexylamino)- [ACD/Index Name]
10.1016/j.bmcl.2013.08.082
1Q4

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 557.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.9±3.0 kJ/mol
Flash Point: 290.8±30.1 °C
Index of Refraction: 1.637
Molar Refractivity: 68.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.52
ACD/LogD (pH 5.5): 1.78
ACD/BCF (pH 5.5): 13.28
ACD/KOC (pH 5.5): 221.58
ACD/LogD (pH 7.4): 1.78
ACD/BCF (pH 7.4): 13.29
ACD/KOC (pH 7.4): 221.74
Polar Surface Area: 67 Å2
Polarizability: 27.1±0.5 10-24cm3
Surface Tension: 64.6±3.0 dyne/cm
Molar Volume: 190.5±3.0 cm3

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