ChemSpider 2D Image | [6-Amino-1-isobutyl-3-(trifluoromethyl)-4-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazol-5-yl](4-morpholinyl)methanone | C25H31F3N4O6

[6-Amino-1-isobutyl-3-(trifluoromethyl)-4-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazol-5-yl](4-morpholinyl)methanone

  • Molecular FormulaC25H31F3N4O6
  • Average mass540.532 Da
  • Monoisotopic mass540.219543 Da
  • ChemSpider ID119851169

More details:

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

[6-Amino-1-isobutyl-3-(trifluormethyl)-4-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazol-5-yl](4-morpholinyl)methanon [German] [ACD/IUPAC Name]
[6-Amino-1-isobutyl-3-(trifluoromethyl)-4-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazol-5-yl](4-morpholinyl)methanone [ACD/IUPAC Name]
[6-Amino-1-isobutyl-3-(trifluorométhyl)-4-(3,4,5-triméthoxyphényl)-1,4-dihydropyrano[2,3-c]pyrazol-5-yl](4-morpholinyl)méthanone [French] [ACD/IUPAC Name]
Methanone, [6-amino-1,4-dihydro-1-(2-methylpropyl)-3-(trifluoromethyl)-4-(3,4,5-trimethoxyphenyl)pyrano[2,3-c]pyrazol-5-yl]-4-morpholinyl- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 624.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.5±3.0 kJ/mol
Flash Point: 331.8±31.5 °C
Index of Refraction: 1.580
Molar Refractivity: 127.5±0.5 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 2.56
ACD/LogD (pH 5.5): 2.23
ACD/BCF (pH 5.5): 29.15
ACD/KOC (pH 5.5): 388.07
ACD/LogD (pH 7.4): 2.23
ACD/BCF (pH 7.4): 29.40
ACD/KOC (pH 7.4): 391.45
Polar Surface Area: 110 Å2
Polarizability: 50.5±0.5 10-24cm3
Surface Tension: 42.0±7.0 dyne/cm
Molar Volume: 382.9±7.0 cm3

Click to predict properties on the Chemicalize site


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