ChemSpider 2D Image | N-(2-{4-[(Z)-({[(5-{[(4-Ethoxyphenyl)amino]methyl}-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}hydrazono)methyl]-2-methoxyphenoxy}ethyl)acetamide | C26H33N7O5S

N-(2-{4-[(Z)-({[(5-{[(4-Ethoxyphenyl)amino]methyl}-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}hydrazono)methyl]-2-methoxyphenoxy}ethyl)acetamide

  • Molecular FormulaC26H33N7O5S
  • Average mass555.649 Da
  • Monoisotopic mass555.226379 Da
  • ChemSpider ID100098580

  • Double-bond stereo - Double-bond stereo

More details:

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

Acetic acid, 2-[[5-[[(4-ethoxyphenyl)amino]methyl]-4-methyl-4H-1,2,4-triazol-3-yl]thio]-, 2-[(1Z)-[4-[2-(acetylamino)ethoxy]-3-methoxyphenyl]methylene]hydrazide [ACD/Index Name]
N-(2-{4-[(Z)-({[(5-{[(4-Ethoxyphenyl)amino]methyl}-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}hydrazono)methyl]-2-methoxyphenoxy}ethyl)acetamid [German] [ACD/IUPAC Name]
N-(2-{4-[(Z)-({[(5-{[(4-Ethoxyphenyl)amino]methyl}-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}hydrazono)methyl]-2-methoxyphenoxy}ethyl)acetamide [ACD/IUPAC Name]
N-(2-{4-[(Z)-({2-[(5-{[(4-Éthoxyphényl)amino]méthyl}-4-méthyl-4H-1,2,4-triazol-3-yl)sulfanyl]acétyl}hydrazono)méthyl]-2-méthoxyphénoxy}éthyl)acétamide [French] [ACD/IUPAC Name]

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: 1.616
Molar Refractivity: 150.0±0.5 cm3
#H bond acceptors: 12
#H bond donors: 3
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 2
ACD/LogP: 2.85
ACD/LogD (pH 5.5): 2.30
ACD/BCF (pH 5.5): 32.85
ACD/KOC (pH 5.5): 422.21
ACD/LogD (pH 7.4): 2.31
ACD/BCF (pH 7.4): 33.27
ACD/KOC (pH 7.4): 427.59
Polar Surface Area: 166 Å2
Polarizability: 59.4±0.5 10-24cm3
Surface Tension: 49.0±7.0 dyne/cm
Molar Volume: 429.0±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement