ChemSpider 2D Image | 5-Amino-1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-N-[4-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxamide | C21H17F3N6O2

5-Amino-1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-N-[4-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxamide

  • Molecular FormulaC21H17F3N6O2
  • Average mass442.394 Da
  • Monoisotopic mass442.136505 Da
  • ChemSpider ID21778321

More details:

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

1H-1,2,3-Triazole-4-carboxamide, 5-amino-1-[(5-methyl-2-phenyl-4-oxazolyl)methyl]-N-[4-(trifluoromethyl)phenyl]- [ACD/Index Name]
5-Amino-1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-N-[4-(trifluormethyl)phenyl]-1H-1,2,3-triazol-4-carboxamid [German] [ACD/IUPAC Name]
5-Amino-1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-N-[4-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxamide [ACD/IUPAC Name]
5-Amino-1-[(5-méthyl-2-phényl-1,3-oxazol-4-yl)méthyl]-N-[4-(trifluorométhyl)phényl]-1H-1,2,3-triazole-4-carboxamide [French] [ACD/IUPAC Name]
1115896-16-6 [RN]
2-{4-[(4-methoxybenzyl)thio]-1H-pyrrolo[3,2-c]pyridin-1-yl}-N-(3-pyrrolidin-1-ylpropyl)acetamide
5-amino-1-((5-methyl-2-phenyloxazol-4-yl)methyl)-N-(4-(trifluoromethyl)phenyl)-1H-1,2,3-triazole-4-carboxamide
5-Amino-1-(5-methyl-2-phenyl-oxazol-4-ylmethyl)-1H-[1,2,3]triazole-4-carboxylic acid (4-trifluoromethyl-phenyl)-amide
5-amino-1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-N-[4-(trifluoromethyl)phenyl]triazole-4-carboxamide

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: 1.651
Molar Refractivity: 109.4±0.5 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.16
ACD/LogD (pH 5.5): 2.71
ACD/BCF (pH 5.5): 67.06
ACD/KOC (pH 5.5): 706.31
ACD/LogD (pH 7.4): 2.70
ACD/BCF (pH 7.4): 66.43
ACD/KOC (pH 7.4): 699.67
Polar Surface Area: 112 Å2
Polarizability: 43.4±0.5 10-24cm3
Surface Tension: 50.5±7.0 dyne/cm
Molar Volume: 299.7±7.0 cm3

Click to predict properties on the Chemicalize site


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