ChemSpider 2D Image | N'-{(Z)-[3-(4-Cyanophenoxy)phenyl]methylene}-2-[(5-{1-[(3-methylphenyl)amino]ethyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetohydrazide | C33H29N7O2S

N'-{(Z)-[3-(4-Cyanophenoxy)phenyl]methylene}-2-[(5-{1-[(3-methylphenyl)amino]ethyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetohydrazide

  • Molecular FormulaC33H29N7O2S
  • Average mass587.694 Da
  • Monoisotopic mass587.210327 Da
  • ChemSpider ID100091947

  • Double-bond stereo - Double-bond stereo

More details:

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

Acetic acid, 2-[[5-[1-[(3-methylphenyl)amino]ethyl]-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-, 2-[(1Z)-[3-(4-cyanophenoxy)phenyl]methylene]hydrazide [ACD/Index Name]
N'-{(Z)-[3-(4-Cyanophenoxy)phenyl]methylene}-2-[(5-{1-[(3-methylphenyl)amino]ethyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetohydrazide [ACD/IUPAC Name]
N'-{(Z)-[3-(4-Cyanophénoxy)phényl]méthylène}-2-[(5-{1-[(3-méthylphényl)amino]éthyl}-4-phényl-4H-1,2,4-triazol-3-yl)sulfanyl]acétohydrazide [French] [ACD/IUPAC Name]
N'-{(Z)-[3-(4-Cyanphenoxy)phenyl]methylen}-2-[(5-{1-[(3-methylphenyl)amino]ethyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetohydrazid [German] [ACD/IUPAC Name]

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: 1.660
Molar Refractivity: 172.7±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 8.60
ACD/LogD (pH 5.5): 6.74
ACD/BCF (pH 5.5): 77774.58
ACD/KOC (pH 5.5): 110168.88
ACD/LogD (pH 7.4): 6.74
ACD/BCF (pH 7.4): 78004.80
ACD/KOC (pH 7.4): 110494.99
Polar Surface Area: 143 Å2
Polarizability: 68.5±0.5 10-24cm3
Surface Tension: 51.6±7.0 dyne/cm
Molar Volume: 467.9±7.0 cm3

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