ChemSpider 2D Image | (4S)-5-(2-Furylmethyl)-3-(2-hydroxyphenyl)-4-(3,4,5-trimethoxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one | C25H23N3O6

(4S)-5-(2-Furylmethyl)-3-(2-hydroxyphenyl)-4-(3,4,5-trimethoxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one

  • Molecular FormulaC25H23N3O6
  • Average mass461.467 Da
  • Monoisotopic mass461.158691 Da
  • ChemSpider ID62321858

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(4S)-5-(2-Furylmethyl)-3-(2-hydroxyphenyl)-4-(3,4,5-trimethoxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-on [German] [ACD/IUPAC Name]
(4S)-5-(2-Furylmethyl)-3-(2-hydroxyphenyl)-4-(3,4,5-trimethoxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one [ACD/IUPAC Name]
(4S)-5-(2-Furylméthyl)-3-(2-hydroxyphényl)-4-(3,4,5-triméthoxyphényl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one [French] [ACD/IUPAC Name]
Pyrrolo[3,4-c]pyrazol-6(2H)-one, 5-(2-furanylmethyl)-4,5-dihydro-3-(2-hydroxyphenyl)-4-(3,4,5-trimethoxyphenyl)-, (4S)- [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: 677.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 103.0±3.0 kJ/mol
Flash Point: 363.6±31.5 °C
Index of Refraction: 1.643
Molar Refractivity: 122.5±0.3 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 0.93
ACD/LogD (pH 5.5): 2.23
ACD/BCF (pH 5.5): 29.36
ACD/KOC (pH 5.5): 391.01
ACD/LogD (pH 7.4): 2.23
ACD/BCF (pH 7.4): 29.02
ACD/KOC (pH 7.4): 386.52
Polar Surface Area: 110 Å2
Polarizability: 48.5±0.5 10-24cm3
Surface Tension: 60.6±3.0 dyne/cm
Molar Volume: 338.6±3.0 cm3

Click to predict properties on the Chemicalize site


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