Found 25 results

Search term: MF = 'C_{21}H_{17}Cl_{3}N_{4}OS'
ChemSpider 2D Image | 2-{[4-Chloro-1-(3,4-dichlorobenzyl)-1H-pyrazol-3-yl]imino}-3-(2-phenylethyl)-1,3-thiazolidin-4-one | C21H17Cl3N4OS

2-{[4-Chloro-1-(3,4-dichlorobenzyl)-1H-pyrazol-3-yl]imino}-3-(2-phenylethyl)-1,3-thiazolidin-4-one

  • Molecular FormulaC21H17Cl3N4OS
  • Average mass479.810 Da
  • Monoisotopic mass478.018860 Da
  • ChemSpider ID35254869

More details:

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

2-{[4-Chlor-1-(3,4-dichlorbenzyl)-1H-pyrazol-3-yl]imino}-3-(2-phenylethyl)-1,3-thiazolidin-4-on [German] [ACD/IUPAC Name]
2-{[4-Chloro-1-(3,4-dichlorobenzyl)-1H-pyrazol-3-yl]imino}-3-(2-phenylethyl)-1,3-thiazolidin-4-one [ACD/IUPAC Name]
2-{[4-Chloro-1-(3,4-dichlorobenzyl)-1H-pyrazol-3-yl]imino}-3-(2-phényléthyl)-1,3-thiazolidin-4-one [French] [ACD/IUPAC Name]
4-Thiazolidinone, 2-[[4-chloro-1-[(3,4-dichlorophenyl)methyl]-1H-pyrazol-3-yl]imino]-3-(2-phenylethyl)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 649.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.7±3.0 kJ/mol
Flash Point: 346.5±34.3 °C
Index of Refraction: 1.694
Molar Refractivity: 125.6±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.28
ACD/LogD (pH 5.5): 5.35
ACD/BCF (pH 5.5): 6891.48
ACD/KOC (pH 5.5): 19456.08
ACD/LogD (pH 7.4): 5.35
ACD/BCF (pH 7.4): 6891.48
ACD/KOC (pH 7.4): 19456.08
Polar Surface Area: 76 Å2
Polarizability: 49.8±0.5 10-24cm3
Surface Tension: 56.2±7.0 dyne/cm
Molar Volume: 327.1±7.0 cm3

Click to predict properties on the Chemicalize site


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