ChemSpider 2D Image | N'-[(Z)-(1-Allyl-2,3-dihydro-1H-indol-5-yl)methylene]-2-({5-[2-(4-chlorophenyl)cyclopropyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazide | C27H29ClN6OS

N'-[(Z)-(1-Allyl-2,3-dihydro-1H-indol-5-yl)methylene]-2-({5-[2-(4-chlorophenyl)cyclopropyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazide

  • Molecular FormulaC27H29ClN6OS
  • Average mass521.077 Da
  • Monoisotopic mass520.181213 Da
  • ChemSpider ID104706927
  • Double-bond stereo - Double-bond stereo


More details:






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

Acetic acid, 2-[[5-[2-(4-chlorophenyl)cyclopropyl]-4-ethyl-4H-1,2,4-triazol-3-yl]thio]-, 2-[(1Z)-[2,3-dihydro-1-(2-propen-1-yl)-1H-indol-5-yl]methylene]hydrazide [ACD/Index Name]
N'-[(Z)-(1-Allyl-2,3-dihydro-1H-indol-5-yl)methylen]-2-({5-[2-(4-chlorphenyl)cyclopropyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazid [German] [ACD/IUPAC Name]
N'-[(Z)-(1-Allyl-2,3-dihydro-1H-indol-5-yl)methylene]-2-({5-[2-(4-chlorophenyl)cyclopropyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazide [ACD/IUPAC Name]
N'-[(Z)-(1-Allyl-2,3-dihydro-1H-indol-5-yl)méthylène]-2-({5-[2-(4-chlorophényl)cyclopropyl]-4-éthyl-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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.693
Molar Refractivity: 147.3±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 6.25
ACD/LogD (pH 5.5): 5.34
ACD/BCF (pH 5.5): 6712.98
ACD/KOC (pH 5.5): 19054.89
ACD/LogD (pH 7.4): 5.34
ACD/BCF (pH 7.4): 6760.92
ACD/KOC (pH 7.4): 19190.94
Polar Surface Area: 101 Å2
Polarizability: 58.4±0.5 10-24cm3
Surface Tension: 53.7±7.0 dyne/cm
Molar Volume: 383.9±7.0 cm3

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