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

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

  • Molecular FormulaC22H21F6N5O3
  • Average mass517.424 Da
  • Monoisotopic mass517.154846 Da
  • ChemSpider ID123935469

More details:

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

Benzamide, N-[3-[ethyl(2-hydroxyethyl)amino]-1-(4-methoxyphenyl)-1H-1,2,4-triazol-5-yl]-3,5-bis(trifluoromethyl)- [ACD/Index Name]
N-{3-[Ethyl(2-hydroxyethyl)amino]-1-(4-methoxyphenyl)-1H-1,2,4-triazol-5-yl}-3,5-bis(trifluormethyl)benzamid [German] [ACD/IUPAC Name]
N-{3-[Ethyl(2-hydroxyethyl)amino]-1-(4-methoxyphenyl)-1H-1,2,4-triazol-5-yl}-3,5-bis(trifluoromethyl)benzamide [ACD/IUPAC Name]
N-{3-[Éthyl(2-hydroxyéthyl)amino]-1-(4-méthoxyphényl)-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: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.553
Molar Refractivity: 116.4±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 5.02
ACD/LogD (pH 5.5): 4.56
ACD/BCF (pH 5.5): 1727.66
ACD/KOC (pH 5.5): 7218.76
ACD/LogD (pH 7.4): 4.57
ACD/BCF (pH 7.4): 1734.03
ACD/KOC (pH 7.4): 7245.42
Polar Surface Area: 93 Å2
Polarizability: 46.1±0.5 10-24cm3
Surface Tension: 39.7±7.0 dyne/cm
Molar Volume: 363.9±7.0 cm3

Click to predict properties on the Chemicalize site


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