ChemSpider 2D Image | [4-(4-Methoxyphenoxy)-2-(1-piperidinyl)-7,8-dihydropyrido[4,3-d]pyrimidin-6(5H)-yl][4-(trifluoromethyl)phenyl]methanone | C27H27F3N4O3

[4-(4-Methoxyphenoxy)-2-(1-piperidinyl)-7,8-dihydropyrido[4,3-d]pyrimidin-6(5H)-yl][4-(trifluoromethyl)phenyl]methanone

  • Molecular FormulaC27H27F3N4O3
  • Average mass512.523 Da
  • Monoisotopic mass512.203552 Da
  • ChemSpider ID22780155

More details:

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

[4-(4-Methoxyphenoxy)-2-(1-piperidinyl)-7,8-dihydropyrido[4,3-d]pyrimidin-6(5H)-yl][4-(trifluormethyl)phenyl]methanon [German] [ACD/IUPAC Name]
[4-(4-Methoxyphenoxy)-2-(1-piperidinyl)-7,8-dihydropyrido[4,3-d]pyrimidin-6(5H)-yl][4-(trifluoromethyl)phenyl]methanone [ACD/IUPAC Name]
[4-(4-Méthoxyphénoxy)-2-(1-pipéridinyl)-7,8-dihydropyrido[4,3-d]pyrimidin-6(5H)-yl][4-(trifluorométhyl)phényl]méthanone [French] [ACD/IUPAC Name]
Methanone, [7,8-dihydro-4-(4-methoxyphenoxy)-2-(1-piperidinyl)pyrido[4,3-d]pyrimidin-6(5H)-yl][4-(trifluoromethyl)phenyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 657.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.8±3.0 kJ/mol
Flash Point: 351.3±34.3 °C
Index of Refraction: 1.583
Molar Refractivity: 130.7±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 5.46
ACD/LogD (pH 5.5): 5.16
ACD/BCF (pH 5.5): 4603.14
ACD/KOC (pH 5.5): 13630.80
ACD/LogD (pH 7.4): 5.26
ACD/BCF (pH 7.4): 5806.85
ACD/KOC (pH 7.4): 17195.22
Polar Surface Area: 68 Å2
Polarizability: 51.8±0.5 10-24cm3
Surface Tension: 49.5±3.0 dyne/cm
Molar Volume: 391.2±3.0 cm3

Click to predict properties on the Chemicalize site


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