ChemSpider 2D Image | N'-[(Z)-(5-Chloro-2-isobutoxyphenyl)methylene]-2-{[5-(1,5-dimethyl-1H-pyrazol-3-yl)-4-(tetrahydro-2-furanylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide | C25H32ClN7O3S

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

  • Molecular FormulaC25H32ClN7O3S
  • Average mass546.085 Da
  • Monoisotopic mass545.197571 Da
  • ChemSpider ID81868744

  • 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-[(tetrahydro-2-furanyl)methyl]-4H-1,2,4-triazol-3-yl]thio]-, 2-[(1Z)-[5-chloro-2-(2-methylpropoxy)phenyl]methylene]hydrazide [ACD/Index Name]
N'-[(Z)-(5-Chlor-2-isobutoxyphenyl)methylen]-2-{[5-(1,5-dimethyl-1H-pyrazol-3-yl)-4-(tetrahydro-2-furanylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazid [German] [ACD/IUPAC Name]
N'-[(Z)-(5-Chloro-2-isobutoxyphenyl)methylene]-2-{[5-(1,5-dimethyl-1H-pyrazol-3-yl)-4-(tetrahydro-2-furanylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide [ACD/IUPAC Name]
N'-[(Z)-(5-Chloro-2-isobutoxyphényl)méthylène]-2-{[5-(1,5-diméthyl-1H-pyrazol-3-yl)-4-(tétrahydro-2-furanylméthyl)-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: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.659
Molar Refractivity: 146.1±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 3
ACD/LogP: 5.00
ACD/LogD (pH 5.5): 4.34
ACD/BCF (pH 5.5): 1166.80
ACD/KOC (pH 5.5): 5457.01
ACD/LogD (pH 7.4): 4.34
ACD/BCF (pH 7.4): 1166.58
ACD/KOC (pH 7.4): 5455.99
Polar Surface Area: 134 Å2
Polarizability: 57.9±0.5 10-24cm3
Surface Tension: 51.2±7.0 dyne/cm
Molar Volume: 396.1±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement