ChemSpider 2D Image | N-{3-[Bis(2-hydroxyethyl)amino]-1-(4-methylphenyl)-1H-1,2,4-triazol-5-yl}-3,5-bis(trifluoromethyl)benzamide | C22H21F6N5O3

N-{3-[Bis(2-hydroxyethyl)amino]-1-(4-methylphenyl)-1H-1,2,4-triazol-5-yl}-3,5-bis(trifluoromethyl)benzamide

  • Molecular FormulaC22H21F6N5O3
  • Average mass517.424 Da
  • Monoisotopic mass517.154846 Da
  • ChemSpider ID123125600

More details:

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

Benzamide, N-[3-[bis(2-hydroxyethyl)amino]-1-(4-methylphenyl)-1H-1,2,4-triazol-5-yl]-3,5-bis(trifluoromethyl)- [ACD/Index Name]
N-{3-[Bis(2-hydroxyethyl)amino]-1-(4-methylphenyl)-1H-1,2,4-triazol-5-yl}-3,5-bis(trifluormethyl)benzamid [German] [ACD/IUPAC Name]
N-{3-[Bis(2-hydroxyethyl)amino]-1-(4-methylphenyl)-1H-1,2,4-triazol-5-yl}-3,5-bis(trifluoromethyl)benzamide [ACD/IUPAC Name]
N-{3-[Bis(2-hydroxyéthyl)amino]-1-(4-méthylphényl)-1H-1,2,4-triazol-5-yl}-3,5-bis(trifluorométhyl)benzamide [French] [ACD/IUPAC 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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.566
Molar Refractivity: 116.0±0.5 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 4.40
ACD/LogD (pH 5.5): 3.77
ACD/BCF (pH 5.5): 425.93
ACD/KOC (pH 5.5): 2634.17
ACD/LogD (pH 7.4): 3.78
ACD/BCF (pH 7.4): 436.28
ACD/KOC (pH 7.4): 2698.15
Polar Surface Area: 104 Å2
Polarizability: 46.0±0.5 10-24cm3
Surface Tension: 42.4±7.0 dyne/cm
Molar Volume: 355.5±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement