Found 178 results

Search term: MF = 'C_{17}H_{21}F_{3}N_{4}OS'
ChemSpider 2D Image | N-{2-[5-(Isobutylsulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]ethyl}-2-(trifluoromethyl)benzamide | C17H21F3N4OS

N-{2-[5-(Isobutylsulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]ethyl}-2-(trifluoromethyl)benzamide

  • Molecular FormulaC17H21F3N4OS
  • Average mass386.435 Da
  • Monoisotopic mass386.138824 Da
  • ChemSpider ID22231411

More details:

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

Benzamide, N-[2-[4-methyl-5-[(2-methylpropyl)thio]-4H-1,2,4-triazol-3-yl]ethyl]-2-(trifluoromethyl)- [ACD/Index Name]
N-{2-[5-(Isobutylsulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]ethyl}-2-(trifluormethyl)benzamid [German] [ACD/IUPAC Name]
N-{2-[5-(Isobutylsulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]ethyl}-2-(trifluoromethyl)benzamide [ACD/IUPAC Name]
N-{2-[5-(Isobutylsulfanyl)-4-méthyl-4H-1,2,4-triazol-3-yl]éthyl}-2-(trifluorométhyl)benzamide [French] [ACD/IUPAC Name]
N-{2-[5-(isobutylthio)-4-methyl-4H-1,2,4-triazol-3-yl]ethyl}-2-(trifluoromethyl)benzamide

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.567
Molar Refractivity: 97.2±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.01
ACD/LogD (pH 5.5): 4.14
ACD/BCF (pH 5.5): 828.19
ACD/KOC (pH 5.5): 4269.09
ACD/LogD (pH 7.4): 4.14
ACD/BCF (pH 7.4): 828.59
ACD/KOC (pH 7.4): 4271.19
Polar Surface Area: 85 Å2
Polarizability: 38.5±0.5 10-24cm3
Surface Tension: 38.9±7.0 dyne/cm
Molar Volume: 297.4±7.0 cm3

Click to predict properties on the Chemicalize site


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