ChemSpider 2D Image | 5-Amino-N-(3,4-dimethoxyphenyl)-1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1H-1,2,3-triazole-4-carboxamide | C22H22N6O4

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

  • Molecular FormulaC22H22N6O4
  • Average mass434.448 Da
  • Monoisotopic mass434.170258 Da
  • ChemSpider ID26023057

More details:

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

1H-1,2,3-Triazole-4-carboxamide, 5-amino-N-(3,4-dimethoxyphenyl)-1-[(5-methyl-2-phenyl-4-oxazolyl)methyl]- [ACD/Index Name]
5-Amino-N-(3,4-dimethoxyphenyl)-1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1H-1,2,3-triazol-4-carboxamid [German] [ACD/IUPAC Name]
5-Amino-N-(3,4-dimethoxyphenyl)-1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1H-1,2,3-triazole-4-carboxamide [ACD/IUPAC Name]
5-Amino-N-(3,4-diméthoxyphényl)-1-[(5-méthyl-2-phényl-1,3-oxazol-4-yl)méthyl]-1H-1,2,3-triazole-4-carboxamide [French] [ACD/IUPAC Name]
1112434-01-1 [RN]
5-Amino-1-(5-methyl-2-phenyl-oxazol-4-ylmethyl)-1H-[1,2,3]triazole-4-carboxylic acid (3,4-dimethoxy-phenyl)-amide
5-amino-N-(3,4-dimethoxyphenyl)-1-((5-methyl-2-phenyloxazol-4-yl)methyl)-1H-1,2,3-triazole-4-carboxamide
5-amino-N-(3,4-dimethoxyphenyl)-1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]triazole-4-carboxamide

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: 1.666
Molar Refractivity: 116.3±0.5 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 2.17
ACD/LogD (pH 5.5): 1.82
ACD/BCF (pH 5.5): 14.20
ACD/KOC (pH 5.5): 232.46
ACD/LogD (pH 7.4): 1.81
ACD/BCF (pH 7.4): 13.88
ACD/KOC (pH 7.4): 227.25
Polar Surface Area: 130 Å2
Polarizability: 46.1±0.5 10-24cm3
Surface Tension: 53.3±7.0 dyne/cm
Molar Volume: 312.9±7.0 cm3

Click to predict properties on the Chemicalize site


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