ChemSpider 2D Image | Asp-5878 | C18H19F2N5O4

Asp-5878

  • Molecular FormulaC18H19F2N5O4
  • Average mass407.371 Da
  • Monoisotopic mass407.140503 Da
  • ChemSpider ID64853666

More details:

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

1453208-66-6 [RN]
1H-Pyrazole-1-ethanol, 4-[[5-[(2,6-difluoro-3,5-dimethoxyphenyl)methoxy]-2-pyrimidinyl]amino]- [ACD/Index Name]
2-[4-({5-[(2,6-Difluor-3,5-dimethoxybenzyl)oxy]-2-pyrimidinyl}amino)-1H-pyrazol-1-yl]ethanol [German] [ACD/IUPAC Name]
2-[4-({5-[(2,6-Difluoro-3,5-dimethoxybenzyl)oxy]-2-pyrimidinyl}amino)-1H-pyrazol-1-yl]ethanol [ACD/IUPAC Name]
2-[4-({5-[(2,6-Difluoro-3,5-diméthoxybenzyl)oxy]-2-pyrimidinyl}amino)-1H-pyrazol-1-yl]éthanol [French] [ACD/IUPAC Name]
2-[4-({5-[(2,6-difluoro-3,5-dimethoxyphenyl)methoxy]pyrimidin-2-yl}amino)-1H-pyrazol-1-yl]ethan-1-ol
2-[4-({5-[(2,6-difluoro-3,5-dimethoxyphenyl)methoxy]pyrimidin-2-yl}amino)pyrazol-1-yl]ethanol
Asp-5878
C0Z095LL72
1453208-66-6 (free base)
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 645.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 100.0±3.0 kJ/mol
Flash Point: 344.1±34.3 °C
Index of Refraction: 1.601
Molar Refractivity: 98.4±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 1.15
ACD/LogD (pH 5.5): 1.88
ACD/BCF (pH 5.5): 15.81
ACD/KOC (pH 5.5): 250.98
ACD/LogD (pH 7.4): 1.88
ACD/BCF (pH 7.4): 15.82
ACD/KOC (pH 7.4): 251.15
Polar Surface Area: 104 Å2
Polarizability: 39.0±0.5 10-24cm3
Surface Tension: 45.7±7.0 dyne/cm
Molar Volume: 287.1±7.0 cm3

Click to predict properties on the Chemicalize site


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