ChemSpider 2D Image | 4-(2-Fluorophenyl)-2-{4-[4-(1H-indol-3-yl)-1-piperidinyl]butyl}-5,6,7,8-tetrahydro-1H-pyrido[1,2-c]pyrimidine-1,3(2H)-dione | C31H35FN4O2

4-(2-Fluorophenyl)-2-{4-[4-(1H-indol-3-yl)-1-piperidinyl]butyl}-5,6,7,8-tetrahydro-1H-pyrido[1,2-c]pyrimidine-1,3(2H)-dione

  • Molecular FormulaC31H35FN4O2
  • Average mass514.634 Da
  • Monoisotopic mass514.274414 Da
  • ChemSpider ID24642845

More details:

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

1H-Pyrido[1,2-c]pyrimidine-1,3(2H)-dione, 4-(2-fluorophenyl)-5,6,7,8-tetrahydro-2-[4-[4-(1H-indol-3-yl)-1-piperidinyl]butyl]- [ACD/Index Name]
4-(2-Fluorophenyl)-2-{4-[4-(1H-indol-3-yl)-1-piperidinyl]butyl}-5,6,7,8-tetrahydro-1H-pyrido[1,2-c]pyrimidine-1,3(2H)-dione [ACD/IUPAC Name]
4-(2-Fluorophényl)-2-{4-[4-(1H-indol-3-yl)-1-pipéridinyl]butyl}-5,6,7,8-tétrahydro-1H-pyrido[1,2-c]pyrimidine-1,3(2H)-dione [French] [ACD/IUPAC Name]
4-(2-Fluorphenyl)-2-{4-[4-(1H-indol-3-yl)-1-piperidinyl]butyl}-5,6,7,8-tetrahydro-1H-pyrido[1,2-c]pyrimidin-1,3(2H)-dion [German] [ACD/IUPAC 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: 699.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.4±3.0 kJ/mol
Flash Point: 376.7±34.3 °C
Index of Refraction: 1.669
Molar Refractivity: 147.0±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 6.62
ACD/LogD (pH 5.5): 2.67
ACD/BCF (pH 5.5): 11.54
ACD/KOC (pH 5.5): 26.95
ACD/LogD (pH 7.4): 3.50
ACD/BCF (pH 7.4): 78.75
ACD/KOC (pH 7.4): 183.86
Polar Surface Area: 60 Å2
Polarizability: 58.3±0.5 10-24cm3
Surface Tension: 63.5±5.0 dyne/cm
Molar Volume: 393.7±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement