ChemSpider 2D Image | 2-[(4,5-Diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N'-{(Z)-[4-(4-isopropyl-1-piperazinyl)phenyl]methylene}acetohydrazide | C30H33N7OS

2-[(4,5-Diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N'-{(Z)-[4-(4-isopropyl-1-piperazinyl)phenyl]methylene}acetohydrazide

  • Molecular FormulaC30H33N7OS
  • Average mass539.694 Da
  • Monoisotopic mass539.246704 Da
  • ChemSpider ID99515110

  • Double-bond stereo - Double-bond stereo

More details:

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

2-[(4,5-Diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N'-{(Z)-[4-(4-isopropyl-1-piperazinyl)phenyl]methylen}acetohydrazid [German] [ACD/IUPAC Name]
2-[(4,5-Diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N'-{(Z)-[4-(4-isopropyl-1-piperazinyl)phenyl]methylene}acetohydrazide [ACD/IUPAC Name]
2-[(4,5-Diphényl-4H-1,2,4-triazol-3-yl)sulfanyl]-N'-{(Z)-[4-(4-isopropyl-1-pipérazinyl)phényl]méthylène}acétohydrazide [French] [ACD/IUPAC Name]
Acetic acid, 2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)thio]-, 2-[(1Z)-[4-[4-(1-methylethyl)-1-piperazinyl]phenyl]methylene]hydrazide [ACD/Index 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: 1.662
Molar Refractivity: 160.4±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 7.42
ACD/LogD (pH 5.5): 2.83
ACD/BCF (pH 5.5): 25.04
ACD/KOC (pH 5.5): 83.88
ACD/LogD (pH 7.4): 4.51
ACD/BCF (pH 7.4): 1203.62
ACD/KOC (pH 7.4): 4031.59
Polar Surface Area: 104 Å2
Polarizability: 63.6±0.5 10-24cm3
Surface Tension: 51.3±7.0 dyne/cm
Molar Volume: 433.5±7.0 cm3

Click to predict properties on the Chemicalize site


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