ChemSpider 2D Image | 2-Methoxy-4-{5-methyl-6-[(2-methylphenyl)carbamoyl]-1,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}phenyl 2-fluorobenzoate | C28H24FN5O4

2-Methoxy-4-{5-methyl-6-[(2-methylphenyl)carbamoyl]-1,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}phenyl 2-fluorobenzoate

  • Molecular FormulaC28H24FN5O4
  • Average mass513.520 Da
  • Monoisotopic mass513.181213 Da
  • ChemSpider ID21275999

More details:

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

2-Fluorobenzoate de 2-méthoxy-4-{5-méthyl-6-[(2-méthylphényl)carbamoyl]-1,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}phényle [French] [ACD/IUPAC Name]
2-Methoxy-4-{5-methyl-6-[(2-methylphenyl)carbamoyl]-1,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}phenyl 2-fluorobenzoate [ACD/IUPAC Name]
2-Methoxy-4-{5-methyl-6-[(2-methylphenyl)carbamoyl]-1,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}phenyl-2-fluorbenzoat [German] [ACD/IUPAC Name]
Benzoic acid, 2-fluoro-, 4-[4,7-dihydro-5-methyl-6-[[(2-methylphenyl)amino]carbonyl][1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-2-methoxyphenyl ester [ACD/Index Name]
2-Fluoro-benzoic acid 2-methoxy-4-(5-methyl-6-o-tolylcarbamoyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-phenyl ester
2-methoxy-4-(5-methyl-6-{[(2-methylphenyl)amino]carbonyl}-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)phenyl 2-fluorobenzoate
2-methoxy-4-{5-methyl-6-[(2-methylphenyl)carbamoyl]-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}phenyl 2-fluorobenzoate

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: 1.657
Molar Refractivity: 138.8±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 5.02
ACD/LogD (pH 5.5): 4.76
ACD/BCF (pH 5.5): 2452.63
ACD/KOC (pH 5.5): 9284.72
ACD/LogD (pH 7.4): 4.76
ACD/BCF (pH 7.4): 2455.08
ACD/KOC (pH 7.4): 9294.02
Polar Surface Area: 107 Å2
Polarizability: 55.0±0.5 10-24cm3
Surface Tension: 49.6±7.0 dyne/cm
Molar Volume: 377.6±7.0 cm3

Click to predict properties on the Chemicalize site


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