ChemSpider 2D Image | 2-[5-(4-Chlorophenyl)-1-(2,4-dichlorophenyl)-4-ethyl-1H-pyrazol-3-yl]-1,5,5-trimethyl-1,5-dihydro-4H-imidazole-4-thione | C23H21Cl3N4S

2-[5-(4-Chlorophenyl)-1-(2,4-dichlorophenyl)-4-ethyl-1H-pyrazol-3-yl]-1,5,5-trimethyl-1,5-dihydro-4H-imidazole-4-thione

  • Molecular FormulaC23H21Cl3N4S
  • Average mass491.864 Da
  • Monoisotopic mass490.055237 Da
  • ChemSpider ID24709509

More details:

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

2-[5-(4-Chlorophenyl)-1-(2,4-dichlorophenyl)-4-ethyl-1H-pyrazol-3-yl]-1,5,5-trimethyl-1,5-dihydro-4H-imidazole-4-thione [ACD/IUPAC Name]
2-[5-(4-Chlorophényl)-1-(2,4-dichlorophényl)-4-éthyl-1H-pyrazol-3-yl]-1,5,5-triméthyl-1,5-dihydro-4H-imidazole-4-thione [French] [ACD/IUPAC Name]
2-[5-(4-Chlorphenyl)-1-(2,4-dichlorphenyl)-4-ethyl-1H-pyrazol-3-yl]-1,5,5-trimethyl-1,5-dihydro-4H-imidazol-4-thion [German] [ACD/IUPAC Name]
4H-Imidazole-4-thione, 2-[5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-ethyl-1H-pyrazol-3-yl]-1,5-dihydro-1,5,5-trimethyl- [ACD/Index Name]
1170700-86-3 [RN]
2-(5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-ethyl-1H-pyrazol-3-yl)-1,5,5-trimethyl-1H-imidazole-4(5H)-thione
2-[5-(4-Chlorophenyl)-1-(2,4-dichlorophenyl)-4-ethyl-1H-pyrazol-3-yl]-1,5,5-trimethyl-1,5-dihydroimidazole-4-thione
2-[5-(4-CHLOROPHENYL)-1-(2,4-DICHLOROPHENYL)-4-ETHYL-1H-PYRAZOL-3-YL]-1,5-DIHYDRO-1,5,5-TRIMETHYL-4H-IMIDAZOLE-4-THIONE
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL498746/

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

Density: 1.4±0.1 g/cm3
Boiling Point: 602.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.7±3.0 kJ/mol
Flash Point: 318.3±34.3 °C
Index of Refraction: 1.667
Molar Refractivity: 133.3±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 7.24
ACD/LogD (pH 5.5): 6.38
ACD/BCF (pH 5.5): 41671.14
ACD/KOC (pH 5.5): 70519.47
ACD/LogD (pH 7.4): 6.38
ACD/BCF (pH 7.4): 41721.77
ACD/KOC (pH 7.4): 70605.16
Polar Surface Area: 66 Å2
Polarizability: 52.8±0.5 10-24cm3
Surface Tension: 45.8±7.0 dyne/cm
Molar Volume: 358.0±7.0 cm3

Click to predict properties on the Chemicalize site


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