ChemSpider 2D Image | 5-{[3a-(Hydroxymethyl)-5-(tetrahydro-2H-pyran-4-ylcarbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]methyl}-N-methyl-1,2,4-oxadiazole-3-carboxamide | C18H27N5O5

5-{[3a-(Hydroxymethyl)-5-(tetrahydro-2H-pyran-4-ylcarbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]methyl}-N-methyl-1,2,4-oxadiazole-3-carboxamide

  • Molecular FormulaC18H27N5O5
  • Average mass393.438 Da
  • Monoisotopic mass393.201233 Da
  • ChemSpider ID71268673

More details:

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

1,2,4-Oxadiazole-3-carboxamide, 5-[[hexahydro-3a-(hydroxymethyl)-5-[(tetrahydro-2H-pyran-4-yl)carbonyl]pyrrolo[3,4-c]pyrrol-2(1H)-yl]methyl]-N-methyl- [ACD/Index Name]
5-{[3a-(Hydroxymethyl)-5-(tetrahydro-2H-pyran-4-ylcarbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]methyl}-N-methyl-1,2,4-oxadiazol-3-carboxamid [German] [ACD/IUPAC Name]
5-{[3a-(Hydroxymethyl)-5-(tetrahydro-2H-pyran-4-ylcarbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]methyl}-N-methyl-1,2,4-oxadiazole-3-carboxamide [ACD/IUPAC Name]
5-{[3a-(Hydroxyméthyl)-5-(tétrahydro-2H-pyran-4-ylcarbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]méthyl}-N-méthyl-1,2,4-oxadiazole-3-carboxamide [French] [ACD/IUPAC 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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.585
Molar Refractivity: 97.5±0.3 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: -1.96
ACD/LogD (pH 5.5): -1.55
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.62
ACD/LogD (pH 7.4): -1.29
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.70
Polar Surface Area: 121 Å2
Polarizability: 38.6±0.5 10-24cm3
Surface Tension: 63.5±3.0 dyne/cm
Molar Volume: 291.1±3.0 cm3

Click to predict properties on the Chemicalize site


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