Found 5 results

Search term: MF = 'C_{29}H_{28}N_{8}O_{2}S_{2}'
ChemSpider 2D Image | 2-[(4-Allyl-5-{[(4-methylphenyl)amino]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]-N'-{(Z)-[4-(2,1,3-benzothiadiazol-5-ylmethoxy)phenyl]methylene}acetohydrazide | C29H28N8O2S2

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

  • Molecular FormulaC29H28N8O2S2
  • Average mass584.715 Da
  • Monoisotopic mass584.177673 Da
  • ChemSpider ID100063178

  • Double-bond stereo - Double-bond stereo

More details:

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

2-[(4-Allyl-5-{[(4-methylphenyl)amino]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]-N'-{(Z)-[4-(2,1,3-benzothiadiazol-5-ylmethoxy)phenyl]methylen}acetohydrazid [German] [ACD/IUPAC Name]
2-[(4-Allyl-5-{[(4-methylphenyl)amino]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]-N'-{(Z)-[4-(2,1,3-benzothiadiazol-5-ylmethoxy)phenyl]methylene}acetohydrazide [ACD/IUPAC Name]
2-[(4-Allyl-5-{[(4-méthylphényl)amino]méthyl}-4H-1,2,4-triazol-3-yl)sulfanyl]-N'-{(Z)-[4-(2,1,3-benzothiadiazol-5-ylméthoxy)phényl]méthylène}acétohydrazide [French] [ACD/IUPAC Name]
Acetic acid, 2-[[5-[[(4-methylphenyl)amino]methyl]-4-(2-propen-1-yl)-4H-1,2,4-triazol-3-yl]thio]-, 2-[(1Z)-[4-(2,1,3-benzothiadiazol-5-ylmethoxy)phenyl]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: 1.699
Molar Refractivity: 166.3±0.5 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 3
ACD/LogP: 6.51
ACD/LogD (pH 5.5): 5.59
ACD/BCF (pH 5.5): 10409.50
ACD/KOC (pH 5.5): 26084.83
ACD/LogD (pH 7.4): 5.59
ACD/BCF (pH 7.4): 10482.01
ACD/KOC (pH 7.4): 26266.52
Polar Surface Area: 173 Å2
Polarizability: 65.9±0.5 10-24cm3
Surface Tension: 56.5±7.0 dyne/cm
Molar Volume: 430.8±7.0 cm3

Click to predict properties on the Chemicalize site


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