ChemSpider 2D Image | 2-{[4-Amino-5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2,4-dihydroxyphenyl)methylene]acetohydrazide | C17H15N7O5S

2-{[4-Amino-5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2,4-dihydroxyphenyl)methylene]acetohydrazide

  • Molecular FormulaC17H15N7O5S
  • Average mass429.410 Da
  • Monoisotopic mass429.085541 Da
  • ChemSpider ID68421554

  • Double-bond stereo - Double-bond stereo

More details:

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

2-{[4-Amino-5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2,4-dihydroxyphenyl)methylen]acetohydrazid [German] [ACD/IUPAC Name]
2-{[4-Amino-5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2,4-dihydroxyphenyl)methylene]acetohydrazide [ACD/IUPAC Name]
2-{[4-Amino-5-(3-nitrophényl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2,4-dihydroxyphényl)méthylène]acétohydrazide [French] [ACD/IUPAC Name]
Acetic acid, 2-[[4-amino-5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl]thio]-, 2-[(1E)-(2,4-dihydroxyphenyl)methylene]hydrazide [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.769
Molar Refractivity: 107.4±0.5 cm3
#H bond acceptors: 12
#H bond donors: 5
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 4.01
ACD/LogD (pH 5.5): 2.19
ACD/BCF (pH 5.5): 27.11
ACD/KOC (pH 5.5): 368.82
ACD/LogD (pH 7.4): 2.04
ACD/BCF (pH 7.4): 19.18
ACD/KOC (pH 7.4): 260.92
Polar Surface Area: 210 Å2
Polarizability: 42.6±0.5 10-24cm3
Surface Tension: 82.1±7.0 dyne/cm
Molar Volume: 258.7±7.0 cm3

Click to predict properties on the Chemicalize site


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