ChemSpider 2D Image | 5-{[4-Oxo-2-(4-pyridinyl)-4,5,6,8-tetrahydropyrido[3,4-d]pyrimidin-7(1H)-yl]carbonyl}-2-pyridinecarbonitrile | C19H14N6O2

5-{[4-Oxo-2-(4-pyridinyl)-4,5,6,8-tetrahydropyrido[3,4-d]pyrimidin-7(1H)-yl]carbonyl}-2-pyridinecarbonitrile

  • Molecular FormulaC19H14N6O2
  • Average mass358.353 Da
  • Monoisotopic mass358.117828 Da
  • ChemSpider ID29580574

More details:






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

2-Pyridinecarbonitrile, 5-[[4,5,6,8-tetrahydro-4-oxo-2-(4-pyridinyl)pyrido[3,4-d]pyrimidin-7(3H)-yl]carbonyl]- [ACD/Index Name]
5-{[4-Oxo-2-(4-pyridinyl)-4,5,6,8-tetrahydropyrido[3,4-d]pyrimidin-7(1H)-yl]carbonyl}-2-pyridincarbonitril [German] [ACD/IUPAC Name]
5-{[4-Oxo-2-(4-pyridinyl)-4,5,6,8-tetrahydropyrido[3,4-d]pyrimidin-7(1H)-yl]carbonyl}-2-pyridinecarbonitrile [ACD/IUPAC Name]
5-{[4-Oxo-2-(4-pyridinyl)-4,5,6,8-tétrahydropyrido[3,4-d]pyrimidin-7(1H)-yl]carbonyl}-2-pyridinecarbonitrile [French] [ACD/IUPAC Name]
5-[(4-oxo-2-pyridin-4-yl-4,5,6,8-tetrahydropyrido[3,4-d]pyrimidin-7(3H)-yl)carbonyl]pyridine-2-carbonitrile

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.748
Molar Refractivity: 99.7±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.50
ACD/LogD (pH 5.5): -0.42
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 13.98
ACD/LogD (pH 7.4): -0.51
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 11.30
Polar Surface Area: 111 Å2
Polarizability: 39.5±0.5 10-24cm3
Surface Tension: 66.5±7.0 dyne/cm
Molar Volume: 245.3±7.0 cm3

Click to predict properties on the Chemicalize site






Advertisement