ChemSpider 2D Image | 5-[(3,4-Dimethoxyphenyl)sulfonyl]-3-[3-(2-methoxyethyl)-1,2,4-oxadiazol-5-yl]-1-methyl-1,4,5,6-tetrahydropyrrolo[3,4-c]pyrazole | C19H23N5O6S

5-[(3,4-Dimethoxyphenyl)sulfonyl]-3-[3-(2-methoxyethyl)-1,2,4-oxadiazol-5-yl]-1-methyl-1,4,5,6-tetrahydropyrrolo[3,4-c]pyrazole

  • Molecular FormulaC19H23N5O6S
  • Average mass449.481 Da
  • Monoisotopic mass449.136902 Da
  • ChemSpider ID64951133

More details:

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

5-[(3,4-Dimethoxyphenyl)sulfonyl]-3-[3-(2-methoxyethyl)-1,2,4-oxadiazol-5-yl]-1-methyl-1,4,5,6-tetrahydropyrrolo[3,4-c]pyrazol [German] [ACD/IUPAC Name]
5-[(3,4-Dimethoxyphenyl)sulfonyl]-3-[3-(2-methoxyethyl)-1,2,4-oxadiazol-5-yl]-1-methyl-1,4,5,6-tetrahydropyrrolo[3,4-c]pyrazole [ACD/IUPAC Name]
5-[(3,4-Diméthoxyphényl)sulfonyl]-3-[3-(2-méthoxyéthyl)-1,2,4-oxadiazol-5-yl]-1-méthyl-1,4,5,6-tétrahydropyrrolo[3,4-c]pyrazole [French] [ACD/IUPAC Name]
Pyrrolo[3,4-c]pyrazole, 5-[(3,4-dimethoxyphenyl)sulfonyl]-1,4,5,6-tetrahydro-3-[3-(2-methoxyethyl)-1,2,4-oxadiazol-5-yl]-1-methyl- [ACD/Index Name]
3,4-dimethoxyphenyl [3-[3-(2-methoxyethyl)-1,2,4-oxadiazol-5-yl]-1-methyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5(1H)-yl] sulfone

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

Density: 1.5±0.1 g/cm3
Boiling Point: 657.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.8±3.0 kJ/mol
Flash Point: 351.4±34.3 °C
Index of Refraction: 1.659
Molar Refractivity: 111.6±0.5 cm3
#H bond acceptors: 11
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 1.14
ACD/LogD (pH 5.5): 1.88
ACD/BCF (pH 5.5): 15.85
ACD/KOC (pH 5.5): 251.57
ACD/LogD (pH 7.4): 1.88
ACD/BCF (pH 7.4): 15.85
ACD/KOC (pH 7.4): 251.57
Polar Surface Area: 130 Å2
Polarizability: 44.2±0.5 10-24cm3
Surface Tension: 54.9±7.0 dyne/cm
Molar Volume: 302.7±7.0 cm3

Click to predict properties on the Chemicalize site


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