ChemSpider 2D Image | [6-Amino-1-ethyl-4-(4-hydroxy-3,5-dimethoxyphenyl)-3-(trifluoromethyl)-1,4-dihydropyrano[2,3-c]pyrazol-5-yl][2-(2-hydroxyethyl)-1-piperidinyl]methanone | C25H31F3N4O6

[6-Amino-1-ethyl-4-(4-hydroxy-3,5-dimethoxyphenyl)-3-(trifluoromethyl)-1,4-dihydropyrano[2,3-c]pyrazol-5-yl][2-(2-hydroxyethyl)-1-piperidinyl]methanone

  • Molecular FormulaC25H31F3N4O6
  • Average mass540.532 Da
  • Monoisotopic mass540.219543 Da
  • ChemSpider ID119936569

More details:

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

[6-Amino-1-ethyl-4-(4-hydroxy-3,5-dimethoxyphenyl)-3-(trifluormethyl)-1,4-dihydropyrano[2,3-c]pyrazol-5-yl][2-(2-hydroxyethyl)-1-piperidinyl]methanon [German] [ACD/IUPAC Name]
[6-Amino-1-ethyl-4-(4-hydroxy-3,5-dimethoxyphenyl)-3-(trifluoromethyl)-1,4-dihydropyrano[2,3-c]pyrazol-5-yl][2-(2-hydroxyethyl)-1-piperidinyl]methanone [ACD/IUPAC Name]
[6-Amino-1-éthyl-4-(4-hydroxy-3,5-diméthoxyphényl)-3-(trifluorométhyl)-1,4-dihydropyrano[2,3-c]pyrazol-5-yl][2-(2-hydroxyéthyl)-1-pipéridinyl]méthanone [French] [ACD/IUPAC Name]
Methanone, [6-amino-1-ethyl-1,4-dihydro-4-(4-hydroxy-3,5-dimethoxyphenyl)-3-(trifluoromethyl)pyrano[2,3-c]pyrazol-5-yl][2-(2-hydroxyethyl)-1-piperidinyl]- [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: 670.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 103.5±3.0 kJ/mol
Flash Point: 359.4±31.5 °C
Index of Refraction: 1.609
Molar Refractivity: 126.8±0.5 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 1.65
ACD/LogD (pH 5.5): 1.80
ACD/BCF (pH 5.5): 13.79
ACD/KOC (pH 5.5): 226.84
ACD/LogD (pH 7.4): 1.81
ACD/BCF (pH 7.4): 13.87
ACD/KOC (pH 7.4): 228.26
Polar Surface Area: 132 Å2
Polarizability: 50.3±0.5 10-24cm3
Surface Tension: 47.8±7.0 dyne/cm
Molar Volume: 366.2±7.0 cm3

Click to predict properties on the Chemicalize site


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