Found 178 results

Search term: MF = 'C_{17}H_{21}F_{3}N_{4}OS'
ChemSpider 2D Image | 1-[3-(3,5-Dimethyl-1H-pyrazol-4-yl)propyl]-1-methyl-3-{4-[(trifluoromethyl)sulfanyl]phenyl}urea | C17H21F3N4OS

1-[3-(3,5-Dimethyl-1H-pyrazol-4-yl)propyl]-1-methyl-3-{4-[(trifluoromethyl)sulfanyl]phenyl}urea

  • Molecular FormulaC17H21F3N4OS
  • Average mass386.435 Da
  • Monoisotopic mass386.138824 Da
  • ChemSpider ID30940278

More details:

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

1-[3-(3,5-Dimethyl-1H-pyrazol-4-yl)propyl]-1-methyl-3-{4-[(trifluormethyl)sulfanyl]phenyl}harnstoff [German] [ACD/IUPAC Name]
1-[3-(3,5-Dimethyl-1H-pyrazol-4-yl)propyl]-1-methyl-3-{4-[(trifluoromethyl)sulfanyl]phenyl}urea [ACD/IUPAC Name]
1-[3-(3,5-Diméthyl-1H-pyrazol-4-yl)propyl]-1-méthyl-3-{4-[(trifluorométhyl)sulfanyl]phényl}urée [French] [ACD/IUPAC Name]
Urea, N-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propyl]-N-methyl-N'-[4-[(trifluoromethyl)thio]phenyl]- [ACD/Index Name]
N-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propyl]-N-methyl-N'-{4-[(trifluoromethyl)thio]phenyl}urea

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

Density: 1.3±0.1 g/cm3
Boiling Point: 526.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.0±3.0 kJ/mol
Flash Point: 272.0±30.1 °C
Index of Refraction: 1.572
Molar Refractivity: 96.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.87
ACD/LogD (pH 5.5): 3.81
ACD/BCF (pH 5.5): 446.84
ACD/KOC (pH 5.5): 2640.97
ACD/LogD (pH 7.4): 3.87
ACD/BCF (pH 7.4): 511.13
ACD/KOC (pH 7.4): 3020.92
Polar Surface Area: 86 Å2
Polarizability: 38.2±0.5 10-24cm3
Surface Tension: 51.9±5.0 dyne/cm
Molar Volume: 292.7±5.0 cm3

Click to predict properties on the Chemicalize site


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