ChemSpider 2D Image | 2-(4-{(Z)-[({1-[(4-Bromo-1H-pyrazol-1-yl)methyl]-1H-pyrazol-3-yl}carbonyl)hydrazono]methyl}-2-ethoxyphenoxy)-N-(4-ethoxyphenyl)acetamide | C27H28BrN7O5

2-(4-{(Z)-[({1-[(4-Bromo-1H-pyrazol-1-yl)methyl]-1H-pyrazol-3-yl}carbonyl)hydrazono]methyl}-2-ethoxyphenoxy)-N-(4-ethoxyphenyl)acetamide

  • Molecular FormulaC27H28BrN7O5
  • Average mass610.459 Da
  • Monoisotopic mass609.133545 Da
  • ChemSpider ID103658377

  • Double-bond stereo - Double-bond stereo

More details:

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

1H-Pyrazole-3-carboxylic acid, 1-[(4-bromo-1H-pyrazol-1-yl)methyl]-, 2-[(1Z)-[3-ethoxy-4-[2-[(4-ethoxyphenyl)amino]-2-oxoethoxy]phenyl]methylene]hydrazide [ACD/Index Name]
2-(4-{(Z)-[({1-[(4-Brom-1H-pyrazol-1-yl)methyl]-1H-pyrazol-3-yl}carbonyl)hydrazono]methyl}-2-ethoxyphenoxy)-N-(4-ethoxyphenyl)acetamid [German] [ACD/IUPAC Name]
2-(4-{(Z)-[({1-[(4-Bromo-1H-pyrazol-1-yl)methyl]-1H-pyrazol-3-yl}carbonyl)hydrazono]methyl}-2-ethoxyphenoxy)-N-(4-ethoxyphenyl)acetamide [ACD/IUPAC Name]
2-(4-{(Z)-[({1-[(4-Bromo-1H-pyrazol-1-yl)méthyl]-1H-pyrazol-3-yl}carbonyl)hydrazono]méthyl}-2-éthoxyphénoxy)-N-(4-éthoxyphényl)acétamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.644
Molar Refractivity: 153.0±0.5 cm3
#H bond acceptors: 12
#H bond donors: 2
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 3.05
ACD/LogD (pH 5.5): 3.43
ACD/BCF (pH 5.5): 238.89
ACD/KOC (pH 5.5): 1753.53
ACD/LogD (pH 7.4): 3.43
ACD/BCF (pH 7.4): 238.87
ACD/KOC (pH 7.4): 1753.36
Polar Surface Area: 134 Å2
Polarizability: 60.7±0.5 10-24cm3
Surface Tension: 53.4±7.0 dyne/cm
Molar Volume: 422.4±7.0 cm3

Click to predict properties on the Chemicalize site


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