ChemSpider 2D Image | N'-{(E)-[4-(Diethylamino)-2-hydroxyphenyl]methylene}-2-{[4-(4-methylphenyl)-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide | C27H29N7O2S

N'-{(E)-[4-(Diethylamino)-2-hydroxyphenyl]methylene}-2-{[4-(4-methylphenyl)-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide

  • Molecular FormulaC27H29N7O2S
  • Average mass515.630 Da
  • Monoisotopic mass515.210327 Da
  • ChemSpider ID12273235

  • Double-bond stereo - Double-bond stereo

More details:

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

Acetic acid, 2-[[4-(4-methylphenyl)-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]thio]-, 2-[(1E)-[4-(diethylamino)-2-hydroxyphenyl]methylene]hydrazide [ACD/Index Name]
N'-{(E)-[4-(Diethylamino)-2-hydroxyphenyl]methylen}-2-{[4-(4-methylphenyl)-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazid [German] [ACD/IUPAC Name]
N'-{(E)-[4-(Diethylamino)-2-hydroxyphenyl]methylene}-2-{[4-(4-methylphenyl)-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide [ACD/IUPAC Name]
N'-{(E)-[4-(Diéthylamino)-2-hydroxyphényl]méthylène}-2-{[4-(4-méthylphényl)-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acétohydrazide [French] [ACD/IUPAC Name]
N'-{(E)-[4-(Diethylamino)-2-hydroxyphenyl]methylene}-2-{[4-(4-methylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
N-{(1E)-2-[4-(diethylamino)-2-hydroxyphenyl]-1-azavinyl}-2-[4-(4-methylphenyl)-5-(4-pyridyl)(1,2,4-triazol-3-ylthio)]acetamide

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.658
Molar Refractivity: 148.9±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 7.43
ACD/LogD (pH 5.5): 4.71
ACD/BCF (pH 5.5): 2197.97
ACD/KOC (pH 5.5): 8352.97
ACD/LogD (pH 7.4): 4.69
ACD/BCF (pH 7.4): 2064.06
ACD/KOC (pH 7.4): 7844.09
Polar Surface Area: 134 Å2
Polarizability: 59.0±0.5 10-24cm3
Surface Tension: 51.6±7.0 dyne/cm
Molar Volume: 404.2±7.0 cm3

Click to predict properties on the Chemicalize site


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