ChemSpider 2D Image | 1-Ethyl-3,5-dimethyl-N-[5-(2-methyl-2-propanyl)-1,3,4-thiadiazol-2-yl]-1H-pyrazole-4-sulfonamide | C13H21N5O2S2

1-Ethyl-3,5-dimethyl-N-[5-(2-methyl-2-propanyl)-1,3,4-thiadiazol-2-yl]-1H-pyrazole-4-sulfonamide

  • Molecular FormulaC13H21N5O2S2
  • Average mass343.468 Da
  • Monoisotopic mass343.113678 Da
  • ChemSpider ID30206264

More details:

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

1-Ethyl-3,5-dimethyl-N-[5-(2-methyl-2-propanyl)-1,3,4-thiadiazol-2-yl]-1H-pyrazol-4-sulfonamid [German] [ACD/IUPAC Name]
1-Ethyl-3,5-dimethyl-N-[5-(2-methyl-2-propanyl)-1,3,4-thiadiazol-2-yl]-1H-pyrazole-4-sulfonamide [ACD/IUPAC Name]
1-Éthyl-3,5-diméthyl-N-[5-(2-méthyl-2-propanyl)-1,3,4-thiadiazol-2-yl]-1H-pyrazole-4-sulfonamide [French] [ACD/IUPAC Name]
1H-Pyrazole-4-sulfonamide, N-[5-(1,1-dimethylethyl)-1,3,4-thiadiazol-2-yl]-1-ethyl-3,5-dimethyl- [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: 501.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.1±3.0 kJ/mol
Flash Point: 257.4±32.9 °C
Index of Refraction: 1.646
Molar Refractivity: 90.5±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.38
ACD/LogD (pH 5.5): 2.22
ACD/BCF (pH 5.5): 27.11
ACD/KOC (pH 5.5): 348.84
ACD/LogD (pH 7.4): 1.10
ACD/BCF (pH 7.4): 2.07
ACD/KOC (pH 7.4): 26.57
Polar Surface Area: 126 Å2
Polarizability: 35.9±0.5 10-24cm3
Surface Tension: 49.1±7.0 dyne/cm
Molar Volume: 249.5±7.0 cm3

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