ChemSpider 2D Image | 2-({4-Allyl-5-[(1-naphthylamino)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N'-[1-(4-nitrophenyl)ethylidene]acetohydrazide | C26H25N7O3S

2-({4-Allyl-5-[(1-naphthylamino)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N'-[1-(4-nitrophenyl)ethylidene]acetohydrazide

  • Molecular FormulaC26H25N7O3S
  • Average mass515.587 Da
  • Monoisotopic mass515.173950 Da
  • ChemSpider ID4326769

More details:

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

2-({4-Allyl-5-[(1-naphthylamino)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N'-[1-(4-nitrophenyl)ethyliden]acetohydrazid [German] [ACD/IUPAC Name]
2-({4-Allyl-5-[(1-naphthylamino)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N'-[1-(4-nitrophenyl)ethylidene]acetohydrazide [ACD/IUPAC Name]
2-({4-Allyl-5-[(1-naphtylamino)méthyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N'-[1-(4-nitrophényl)éthylidène]acétohydrazide [French] [ACD/IUPAC Name]
Acetic acid, 2-[[5-[(1-naphthalenylamino)methyl]-4-(2-propen-1-yl)-4H-1,2,4-triazol-3-yl]thio]-, 2-[1-(4-nitrophenyl)ethylidene]hydrazide [ACD/Index Name]
2-({5-[(naphthalen-1-ylamino)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N'-[1-(4-nitrophenyl)ethylidene]acetohydrazide

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.676
Molar Refractivity: 145.4±0.5 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 4.95
ACD/LogD (pH 5.5): 4.45
ACD/BCF (pH 5.5): 1409.49
ACD/KOC (pH 5.5): 6242.34
ACD/LogD (pH 7.4): 4.45
ACD/BCF (pH 7.4): 1413.27
ACD/KOC (pH 7.4): 6259.07
Polar Surface Area: 155 Å2
Polarizability: 57.6±0.5 10-24cm3
Surface Tension: 56.2±7.0 dyne/cm
Molar Volume: 386.2±7.0 cm3

Click to predict properties on the Chemicalize site


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