ChemSpider 2D Image | Methyl 2-({[5-(2-hydroxyethyl)-4-methyl-6-oxo-2-[4-(trifluoromethyl)phenyl]-1(6H)-pyrimidinyl]acetyl}amino)benzoate | C24H22F3N3O5

Methyl 2-({[5-(2-hydroxyethyl)-4-methyl-6-oxo-2-[4-(trifluoromethyl)phenyl]-1(6H)-pyrimidinyl]acetyl}amino)benzoate

  • Molecular FormulaC24H22F3N3O5
  • Average mass489.444 Da
  • Monoisotopic mass489.151154 Da
  • ChemSpider ID26032238

More details:

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

2-({2-[5-(2-Hydroxyéthyl)-4-méthyl-6-oxo-2-[4-(trifluorométhyl)phényl]-1(6H)-pyrimidinyl]acétyl}amino)benzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 2-[[2-[5-(2-hydroxyethyl)-4-methyl-6-oxo-2-[4-(trifluoromethyl)phenyl]-1(6H)-pyrimidinyl]acetyl]amino]-, methyl ester [ACD/Index Name]
Methyl 2-({[5-(2-hydroxyethyl)-4-methyl-6-oxo-2-[4-(trifluoromethyl)phenyl]-1(6H)-pyrimidinyl]acetyl}amino)benzoate [ACD/IUPAC Name]
Methyl-2-({[5-(2-hydroxyethyl)-4-methyl-6-oxo-2-[4-(trifluormethyl)phenyl]-1(6H)-pyrimidinyl]acetyl}amino)benzoat [German] [ACD/IUPAC Name]
2-{2-[5-(2-Hydroxy-ethyl)-4-methyl-6-oxo-2-(4-trifluoromethyl-phenyl)-6H-pyrimidin-1-yl]-acetylamino}-benzoic acid methyl ester
methyl 2-({[5-(2-hydroxyethyl)-4-methyl-6-oxo-2-[4-(trifluoromethyl)phenyl]pyrimidin-1(6H)-yl]acetyl}amino)benzoate

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: 1.580
Molar Refractivity: 120.1±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.26
ACD/LogD (pH 5.5): 2.88
ACD/BCF (pH 5.5): 91.01
ACD/KOC (pH 5.5): 878.91
ACD/LogD (pH 7.4): 2.88
ACD/BCF (pH 7.4): 91.01
ACD/KOC (pH 7.4): 878.91
Polar Surface Area: 108 Å2
Polarizability: 47.6±0.5 10-24cm3
Surface Tension: 44.5±7.0 dyne/cm
Molar Volume: 361.1±7.0 cm3

Click to predict properties on the Chemicalize site


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