ChemSpider 2D Image | 2-{[5-(Anilinomethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(Z)-(3,4-difluoro-2-hydroxyphenyl)methylene]acetohydrazide | C24H20F2N6O2S

2-{[5-(Anilinomethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(Z)-(3,4-difluoro-2-hydroxyphenyl)methylene]acetohydrazide

  • Molecular FormulaC24H20F2N6O2S
  • Average mass494.516 Da
  • Monoisotopic mass494.133636 Da
  • ChemSpider ID100040941

  • Double-bond stereo - Double-bond stereo

More details:

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

2-{[5-(Anilinomethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(Z)-(3,4-difluor-2-hydroxyphenyl)methylen]acetohydrazid [German] [ACD/IUPAC Name]
2-{[5-(Anilinomethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(Z)-(3,4-difluoro-2-hydroxyphenyl)methylene]acetohydrazide [ACD/IUPAC Name]
2-{[5-(Anilinométhyl)-4-phényl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(Z)-(3,4-difluoro-2-hydroxyphényl)méthylène]acétohydrazide [French] [ACD/IUPAC Name]
Acetic acid, 2-[[4-phenyl-5-[(phenylamino)methyl]-4H-1,2,4-triazol-3-yl]thio]-, 2-[(1Z)-(3,4-difluoro-2-hydroxyphenyl)methylene]hydrazide [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: 1.666
Molar Refractivity: 131.4±0.5 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 6.87
ACD/LogD (pH 5.5): 4.73
ACD/BCF (pH 5.5): 2158.77
ACD/KOC (pH 5.5): 7764.98
ACD/LogD (pH 7.4): 3.40
ACD/BCF (pH 7.4): 101.13
ACD/KOC (pH 7.4): 363.75
Polar Surface Area: 130 Å2
Polarizability: 52.1±0.5 10-24cm3
Surface Tension: 53.4±7.0 dyne/cm
Molar Volume: 353.6±7.0 cm3

Click to predict properties on the Chemicalize site


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