ChemSpider 2D Image | N'-[(Z)-{3-[(2-Cyanobenzyl)oxy]phenyl}methylene]-2-[(5-{1-[(3-methylphenyl)amino]ethyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetohydrazide | C34H31N7O2S

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

  • Molecular FormulaC34H31N7O2S
  • Average mass601.721 Da
  • Monoisotopic mass601.226013 Da
  • ChemSpider ID100091333

  • 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-[(2-cyanophenyl)methoxy]phenyl]methylene]hydrazide [ACD/Index Name]
N'-[(Z)-{3-[(2-Cyanbenzyl)oxy]phenyl}methylen]-2-[(5-{1-[(3-methylphenyl)amino]ethyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetohydrazid [German] [ACD/IUPAC Name]
N'-[(Z)-{3-[(2-Cyanobenzyl)oxy]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-[(2-Cyanobenzyl)oxy]phényl}méthylène]-2-[(5-{1-[(3-méthylphényl)amino]éthyl}-4-phényl-4H-1,2,4-triazol-3-yl)sulfanyl]acétohydrazide [French] [ACD/IUPAC Name]

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: 1.654
Molar Refractivity: 177.3±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 7.83
ACD/LogD (pH 5.5): 6.52
ACD/BCF (pH 5.5): 53230.85
ACD/KOC (pH 5.5): 83982.09
ACD/LogD (pH 7.4): 6.52
ACD/BCF (pH 7.4): 53389.18
ACD/KOC (pH 7.4): 84231.89
Polar Surface Area: 143 Å2
Polarizability: 70.3±0.5 10-24cm3
Surface Tension: 50.9±7.0 dyne/cm
Molar Volume: 483.9±7.0 cm3

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