ChemSpider 2D Image | N-{1-[2-(Methylsulfonyl)phenyl]-1H-pyrazol-4-yl}-1,2,5-thiadiazole-3-carboxamide | C13H11N5O3S2

N-{1-[2-(Methylsulfonyl)phenyl]-1H-pyrazol-4-yl}-1,2,5-thiadiazole-3-carboxamide

  • Molecular FormulaC13H11N5O3S2
  • Average mass349.388 Da
  • Monoisotopic mass349.030334 Da
  • ChemSpider ID30360250

More details:

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

1,2,5-Thiadiazole-3-carboxamide, N-[1-[2-(methylsulfonyl)phenyl]-1H-pyrazol-4-yl]- [ACD/Index Name]
N-{1-[2-(Methylsulfonyl)phenyl]-1H-pyrazol-4-yl}-1,2,5-thiadiazol-3-carboxamid [German] [ACD/IUPAC Name]
N-{1-[2-(Methylsulfonyl)phenyl]-1H-pyrazol-4-yl}-1,2,5-thiadiazole-3-carboxamide [ACD/IUPAC Name]
N-{1-[2-(Méthylsulfonyl)phényl]-1H-pyrazol-4-yl}-1,2,5-thiadiazole-3-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 516.3±48.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.8±3.0 kJ/mol
Flash Point: 266.1±29.6 °C
Index of Refraction: 1.758
Molar Refractivity: 89.2±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.42
ACD/LogD (pH 5.5): 0.91
ACD/BCF (pH 5.5): 2.88
ACD/KOC (pH 5.5): 74.19
ACD/LogD (pH 7.4): 0.91
ACD/BCF (pH 7.4): 2.88
ACD/KOC (pH 7.4): 74.19
Polar Surface Area: 143 Å2
Polarizability: 35.4±0.5 10-24cm3
Surface Tension: 72.5±7.0 dyne/cm
Molar Volume: 217.2±7.0 cm3

Click to predict properties on the Chemicalize site


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