ChemSpider 2D Image | 7-(1-{[1-(Difluoromethyl)-1H-pyrazol-3-yl]carbonyl}-4-piperidinyl)-2-(dimethylamino)pyrido[4,3-d]pyrimidin-5(6H)-one | C19H21F2N7O2

7-(1-{[1-(Difluoromethyl)-1H-pyrazol-3-yl]carbonyl}-4-piperidinyl)-2-(dimethylamino)pyrido[4,3-d]pyrimidin-5(6H)-one

  • Molecular FormulaC19H21F2N7O2
  • Average mass417.413 Da
  • Monoisotopic mass417.172485 Da
  • ChemSpider ID29867270

More details:

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

7-(1-{[1-(Difluormethyl)-1H-pyrazol-3-yl]carbonyl}-4-piperidinyl)-2-(dimethylamino)pyrido[4,3-d]pyrimidin-5(6H)-on [German] [ACD/IUPAC Name]
7-(1-{[1-(Difluoromethyl)-1H-pyrazol-3-yl]carbonyl}-4-piperidinyl)-2-(dimethylamino)pyrido[4,3-d]pyrimidin-5(6H)-one [ACD/IUPAC Name]
7-(1-{[1-(Difluorométhyl)-1H-pyrazol-3-yl]carbonyl}-4-pipéridinyl)-2-(diméthylamino)pyrido[4,3-d]pyrimidin-5(6H)-one [French] [ACD/IUPAC Name]
Pyrido[4,3-d]pyrimidin-5(6H)-one, 7-[1-[[1-(difluoromethyl)-1H-pyrazol-3-yl]carbonyl]-4-piperidinyl]-2-(dimethylamino)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 694.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 105.3±3.0 kJ/mol
Flash Point: 373.5±34.3 °C
Index of Refraction: 1.693
Molar Refractivity: 105.1±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -2.24
ACD/LogD (pH 5.5): -2.11
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.11
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 100 Å2
Polarizability: 41.7±0.5 10-24cm3
Surface Tension: 55.2±7.0 dyne/cm
Molar Volume: 274.0±7.0 cm3

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