ChemSpider 2D Image | N'-[(Z)-(3-Chloro-5-nitrophenyl)methylene]-2-{[5-(1,5-dimethyl-1H-pyrazol-3-yl)-4-isobutyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide | C20H23ClN8O3S

N'-[(Z)-(3-Chloro-5-nitrophenyl)methylene]-2-{[5-(1,5-dimethyl-1H-pyrazol-3-yl)-4-isobutyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide

  • Molecular FormulaC20H23ClN8O3S
  • Average mass490.966 Da
  • Monoisotopic mass490.130249 Da
  • ChemSpider ID81864641

  • Double-bond stereo - Double-bond stereo

More details:

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

Acetic acid, 2-[[5-(1,5-dimethyl-1H-pyrazol-3-yl)-4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]thio]-, 2-[(1Z)-(3-chloro-5-nitrophenyl)methylene]hydrazide [ACD/Index Name]
N'-[(Z)-(3-Chlor-5-nitrophenyl)methylen]-2-{[5-(1,5-dimethyl-1H-pyrazol-3-yl)-4-isobutyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazid [German] [ACD/IUPAC Name]
N'-[(Z)-(3-Chloro-5-nitrophenyl)methylene]-2-{[5-(1,5-dimethyl-1H-pyrazol-3-yl)-4-isobutyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide [ACD/IUPAC Name]
N'-[(Z)-(3-Chloro-5-nitrophényl)méthylène]-2-{[5-(1,5-diméthyl-1H-pyrazol-3-yl)-4-isobutyl-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: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.688
Molar Refractivity: 128.4±0.5 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 5.18
ACD/LogD (pH 5.5): 4.26
ACD/BCF (pH 5.5): 1012.13
ACD/KOC (pH 5.5): 4928.86
ACD/LogD (pH 7.4): 4.26
ACD/BCF (pH 7.4): 1011.88
ACD/KOC (pH 7.4): 4927.65
Polar Surface Area: 161 Å2
Polarizability: 50.9±0.5 10-24cm3
Surface Tension: 57.8±7.0 dyne/cm
Molar Volume: 336.8±7.0 cm3

Click to predict properties on the Chemicalize site


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