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Search term: VAHNSEIURMSJCK-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 2,4-Dihydroxy-N-methyl-5-[4-(2-methylphenyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]-N-(2-thienylmethyl)benzamide | C22H20N4O4S

2,4-Dihydroxy-N-methyl-5-[4-(2-methylphenyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]-N-(2-thienylmethyl)benzamide

  • Molecular FormulaC22H20N4O4S
  • Average mass436.484 Da
  • Monoisotopic mass436.120514 Da
  • ChemSpider ID76811374

More details:

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

2,4-Dihydroxy-N-methyl-5-[4-(2-methylphenyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]-N-(2-thienylmethyl)benzamid [German] [ACD/IUPAC Name]
2,4-Dihydroxy-N-methyl-5-[4-(2-methylphenyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]-N-(2-thienylmethyl)benzamide [ACD/IUPAC Name]
2,4-Dihydroxy-N-méthyl-5-[4-(2-méthylphényl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]-N-(2-thiénylméthyl)benzamide [French] [ACD/IUPAC Name]
Benzamide, 5-[4,5-dihydro-4-(2-methylphenyl)-5-oxo-1H-1,2,4-triazol-3-yl]-2,4-dihydroxy-N-methyl-N-(2-thienylmethyl)- [ACD/Index Name]

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: 1.705
Molar Refractivity: 118.6±0.5 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.51
ACD/LogD (pH 5.5): 1.45
ACD/BCF (pH 5.5): 3.79
ACD/KOC (pH 5.5): 40.81
ACD/LogD (pH 7.4): 0.59
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.70
Polar Surface Area: 134 Å2
Polarizability: 47.0±0.5 10-24cm3
Surface Tension: 59.9±7.0 dyne/cm
Molar Volume: 305.3±7.0 cm3

Click to predict properties on the Chemicalize site


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