ChemSpider 2D Image | N'-[(E)-(3-Allyl-2-hydroxyphenyl)methylene]-2-{[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide | C31H33N5O2S

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

  • Molecular FormulaC31H33N5O2S
  • Average mass539.691 Da
  • Monoisotopic mass539.235474 Da
  • ChemSpider ID10869976

  • Double-bond stereo - Double-bond stereo

More details:

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

Acetic acid, 2-[[5-[4-(1,1-dimethylethyl)phenyl]-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]-, 2-[(1E)-[2-hydroxy-3-(2-propen-1-yl)phenyl]methylene]hydrazide [ACD/Index Name]
N'-[(E)-(3-Allyl-2-hydroxyphenyl)methylen]-2-({4-(4-methylphenyl)-5-[4-(2-methyl-2-propanyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazid [German] [ACD/IUPAC Name]
N'-[(E)-(3-Allyl-2-hydroxyphenyl)methylene]-2-({4-(4-methylphenyl)-5-[4-(2-methyl-2-propanyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazide [ACD/IUPAC Name]
N'-[(E)-(3-Allyl-2-hydroxyphényl)méthylène]-2-({4-(4-méthylphényl)-5-[4-(2-méthyl-2-propanyl)phényl]-4H-1,2,4-triazol-3-yl}sulfanyl)acétohydrazide [French] [ACD/IUPAC Name]
N'-[(E)-(3-Allyl-2-hydroxyphenyl)methylene]-2-{[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
(E)-N'-(3-allyl-2-hydroxybenzylidene)-2-((5-(4-(tert-butyl)phenyl)-4-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)acetohydrazide
2-{(E)-[2-({[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-6-(prop-2-en-1-yl)phenolate
379723-19-0 [RN]

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: 1.621
Molar Refractivity: 160.5±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 10.20
ACD/LogD (pH 5.5): 7.31
ACD/BCF (pH 5.5): 212904.16
ACD/KOC (pH 5.5): 226636.08
ACD/LogD (pH 7.4): 7.27
ACD/BCF (pH 7.4): 193493.94
ACD/KOC (pH 7.4): 205973.94
Polar Surface Area: 118 Å2
Polarizability: 63.6±0.5 10-24cm3
Surface Tension: 45.1±7.0 dyne/cm
Molar Volume: 456.5±7.0 cm3

Click to predict properties on the Chemicalize site


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