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Search term: XKELLTLVGRTWDB (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 1,2-Dimethyl-N-(4-{[6-(3,4,5-trimethyl-1H-pyrazol-1-yl)-3-pyridazinyl]amino}phenyl)-1H-imidazole-4-sulfonamide | C21H24N8O2S

1,2-Dimethyl-N-(4-{[6-(3,4,5-trimethyl-1H-pyrazol-1-yl)-3-pyridazinyl]amino}phenyl)-1H-imidazole-4-sulfonamide

  • Molecular FormulaC21H24N8O2S
  • Average mass452.533 Da
  • Monoisotopic mass452.174286 Da
  • ChemSpider ID58500163

More details:

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

1,2-Dimethyl-N-(4-{[6-(3,4,5-trimethyl-1H-pyrazol-1-yl)-3-pyridazinyl]amino}phenyl)-1H-imidazol-4-sulfonamid [German] [ACD/IUPAC Name]
1,2-Dimethyl-N-(4-{[6-(3,4,5-trimethyl-1H-pyrazol-1-yl)-3-pyridazinyl]amino}phenyl)-1H-imidazole-4-sulfonamide [ACD/IUPAC Name]
1,2-Diméthyl-N-(4-{[6-(3,4,5-triméthyl-1H-pyrazol-1-yl)-3-pyridazinyl]amino}phényl)-1H-imidazole-4-sulfonamide [French] [ACD/IUPAC Name]
1H-Imidazole-4-sulfonamide, 1,2-dimethyl-N-[4-[[6-(3,4,5-trimethyl-1H-pyrazol-1-yl)-3-pyridazinyl]amino]phenyl]- [ACD/Index Name]
1,2-dimethyl-N-(4-((6-(3,4,5-trimethyl-1H-pyrazol-1-yl)pyridazin-3-yl)amino)phenyl)-1H-imidazole-4-sulfonamide

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

Density: 1.4±0.1 g/cm3
Boiling Point: 748.8±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 109.1±3.0 kJ/mol
Flash Point: 406.7±35.7 °C
Index of Refraction: 1.698
Molar Refractivity: 124.2±0.5 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: -0.03
ACD/LogD (pH 5.5): 2.07
ACD/BCF (pH 5.5): 21.58
ACD/KOC (pH 5.5): 307.92
ACD/LogD (pH 7.4): 1.43
ACD/BCF (pH 7.4): 4.99
ACD/KOC (pH 7.4): 71.14
Polar Surface Area: 128 Å2
Polarizability: 49.2±0.5 10-24cm3
Surface Tension: 54.8±7.0 dyne/cm
Molar Volume: 322.1±7.0 cm3

Click to predict properties on the Chemicalize site


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