Found 104 results

Search term: MF = 'C_{22}H_{16}F_{3}N_{5}O_{4}'
ChemSpider 2D Image | Methyl 2-({[5-(4-methoxyphenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)benzoate | C22H16F3N5O4

Methyl 2-({[5-(4-methoxyphenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)benzoate

  • Molecular FormulaC22H16F3N5O4
  • Average mass471.389 Da
  • Monoisotopic mass471.115448 Da
  • ChemSpider ID28351149

More details:

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

2-({[5-(4-Méthoxyphényl)-7-(trifluorométhyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)benzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 2-[[[5-(4-methoxyphenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]carbonyl]amino]-, methyl ester [ACD/Index Name]
Methyl 2-({[5-(4-methoxyphenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)benzoate [ACD/IUPAC Name]
Methyl-2-({[5-(4-methoxyphenyl)-7-(trifluormethyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)benzoat [German] [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: 1.628
Molar Refractivity: 114.2±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.46
ACD/LogD (pH 5.5): 3.93
ACD/BCF (pH 5.5): 575.70
ACD/KOC (pH 5.5): 3291.08
ACD/LogD (pH 7.4): 3.93
ACD/BCF (pH 7.4): 571.50
ACD/KOC (pH 7.4): 3267.07
Polar Surface Area: 108 Å2
Polarizability: 45.3±0.5 10-24cm3
Surface Tension: 48.2±7.0 dyne/cm
Molar Volume: 321.8±7.0 cm3

Click to predict properties on the Chemicalize site


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