ChemSpider 2D Image | N'-{(Z)-[2-Chloro-5-(2-methyl-2-propanyl)phenyl]methylene}-2-({4-methyl-5-[(1-naphthylamino)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazide | C27H29ClN6OS

N'-{(Z)-[2-Chloro-5-(2-methyl-2-propanyl)phenyl]methylene}-2-({4-methyl-5-[(1-naphthylamino)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazide

  • Molecular FormulaC27H29ClN6OS
  • Average mass521.077 Da
  • Monoisotopic mass520.181213 Da
  • ChemSpider ID100093494
  • Double-bond stereo - Double-bond stereo


More details:






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

Acetic acid, 2-[[4-methyl-5-[(1-naphthalenylamino)methyl]-4H-1,2,4-triazol-3-yl]thio]-, 2-[(1Z)-[2-chloro-5-(1,1-dimethylethyl)phenyl]methylene]hydrazide [ACD/Index Name]
N'-{(Z)-[2-Chlor-5-(2-methyl-2-propanyl)phenyl]methylen}-2-({4-methyl-5-[(1-naphthylamino)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazid [German] [ACD/IUPAC Name]
N'-{(Z)-[2-Chloro-5-(2-methyl-2-propanyl)phenyl]methylene}-2-({4-methyl-5-[(1-naphthylamino)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazide [ACD/IUPAC Name]
N'-{(Z)-[2-Chloro-5-(2-méthyl-2-propanyl)phényl]méthylène}-2-({4-méthyl-5-[(1-naphtylamino)méthyl]-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: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.647
Molar Refractivity: 149.1±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 7.26
ACD/LogD (pH 5.5): 6.12
ACD/BCF (pH 5.5): 26494.39
ACD/KOC (pH 5.5): 50979.55
ACD/LogD (pH 7.4): 6.12
ACD/BCF (pH 7.4): 26551.09
ACD/KOC (pH 7.4): 51088.65
Polar Surface Area: 110 Å2
Polarizability: 59.1±0.5 10-24cm3
Surface Tension: 48.1±7.0 dyne/cm
Molar Volume: 410.0±7.0 cm3

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