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Search term: MZSXSAQYWJDKGB (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 2-[(4-Ethyl-5-{1-[(2-methoxyphenyl)amino]ethyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide | C15H21N5O2S

2-[(4-Ethyl-5-{1-[(2-methoxyphenyl)amino]ethyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide

  • Molecular FormulaC15H21N5O2S
  • Average mass335.424 Da
  • Monoisotopic mass335.141602 Da
  • ChemSpider ID21802436

More details:

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

2-[(4-Ethyl-5-{1-[(2-methoxyphenyl)amino]ethyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamid [German] [ACD/IUPAC Name]
2-[(4-Ethyl-5-{1-[(2-methoxyphenyl)amino]ethyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide [ACD/IUPAC Name]
2-[(4-Éthyl-5-{1-[(2-méthoxyphényl)amino]éthyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acétamide [French] [ACD/IUPAC Name]
Acetamide, 2-[[4-ethyl-5-[1-[(2-methoxyphenyl)amino]ethyl]-4H-1,2,4-triazol-3-yl]thio]- [ACD/Index Name]
2-({4-ethyl-5-[1-(2-methoxyanilino)ethyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
2-[(4-ethyl-5-{1-[(2-methoxyphenyl)amino]ethyl}-4H-1,2,4-triazol-3-yl)thio]acetamide
2-{4-Ethyl-5-[1-(2-methoxy-phenylamino)-ethyl]-4H-[1,2,4]triazol-3-ylsulfanyl}-acetamide

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

Density: 1.3±0.1 g/cm3
Boiling Point: 598.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.1±3.0 kJ/mol
Flash Point: 315.4±32.9 °C
Index of Refraction: 1.635
Molar Refractivity: 91.1±0.5 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 1.54
ACD/LogD (pH 5.5): 1.50
ACD/BCF (pH 5.5): 8.13
ACD/KOC (pH 5.5): 155.90
ACD/LogD (pH 7.4): 1.50
ACD/BCF (pH 7.4): 8.16
ACD/KOC (pH 7.4): 156.36
Polar Surface Area: 120 Å2
Polarizability: 36.1±0.5 10-24cm3
Surface Tension: 49.9±7.0 dyne/cm
Molar Volume: 254.4±7.0 cm3

Click to predict properties on the Chemicalize site


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