ChemSpider 2D Image | N-{3-[3-Acetyl-5-(3,4-dimethoxyphenyl)-1-(4-methylphenyl)-1,5-dihydro-4H-1,2,4-triazol-4-yl]phenyl}-2-methylbenzamide | C33H32N4O4

N-{3-[3-Acetyl-5-(3,4-dimethoxyphenyl)-1-(4-methylphenyl)-1,5-dihydro-4H-1,2,4-triazol-4-yl]phenyl}-2-methylbenzamide

  • Molecular FormulaC33H32N4O4
  • Average mass548.632 Da
  • Monoisotopic mass548.242371 Da
  • ChemSpider ID3923960

More details:

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

Benzamide, N-[3-[3-acetyl-5-(3,4-dimethoxyphenyl)-1,5-dihydro-1-(4-methylphenyl)-4H-1,2,4-triazol-4-yl]phenyl]-2-methyl- [ACD/Index Name]
N-{3-[3-Acetyl-5-(3,4-dimethoxyphenyl)-1-(4-methylphenyl)-1,5-dihydro-4H-1,2,4-triazol-4-yl]phenyl}-2-methylbenzamid [German] [ACD/IUPAC Name]
N-{3-[3-Acetyl-5-(3,4-dimethoxyphenyl)-1-(4-methylphenyl)-1,5-dihydro-4H-1,2,4-triazol-4-yl]phenyl}-2-methylbenzamide [ACD/IUPAC Name]
N-{3-[3-Acétyl-5-(3,4-diméthoxyphényl)-1-(4-méthylphényl)-1,5-dihydro-4H-1,2,4-triazol-4-yl]phényl}-2-méthylbenzamide [French] [ACD/IUPAC Name]
N-{3-[3-Acetyl-5-(3,4-dimethoxy-phenyl)-1-p-tolyl-1,5-dihydro-[1,2,4]triazol-4-yl]-phenyl}-2-methyl-benzamide

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.619
Molar Refractivity: 159.5±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 4.72
ACD/LogD (pH 5.5): 5.03
ACD/BCF (pH 5.5): 3939.82
ACD/KOC (pH 5.5): 13038.73
ACD/LogD (pH 7.4): 5.03
ACD/BCF (pH 7.4): 3939.82
ACD/KOC (pH 7.4): 13038.73
Polar Surface Area: 83 Å2
Polarizability: 63.2±0.5 10-24cm3
Surface Tension: 44.6±7.0 dyne/cm
Molar Volume: 454.5±7.0 cm3

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