ChemSpider 2D Image | 2-{4-[(Z)-{[2-(4-Bromo-1H-pyrazol-1-yl)propanoyl]hydrazono}methyl]-2-methoxyphenoxy}-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)acetamide | C27H28BrN7O5

2-{4-[(Z)-{[2-(4-Bromo-1H-pyrazol-1-yl)propanoyl]hydrazono}methyl]-2-methoxyphenoxy}-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)acetamide

  • Molecular FormulaC27H28BrN7O5
  • Average mass610.459 Da
  • Monoisotopic mass609.133545 Da
  • ChemSpider ID103465267

  • Double-bond stereo - Double-bond stereo

More details:

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

1H-Pyrazole-1-acetic acid, 4-bromo-α-methyl-, 2-[(1Z)-[4-[2-[(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)amino]-2-oxoethoxy]-3-methoxyphenyl]methylene]hydrazide [ACD/Index Name]
2-{4-[(Z)-{[2-(4-Brom-1H-pyrazol-1-yl)propanoyl]hydrazono}methyl]-2-methoxyphenoxy}-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)acetamid [German] [ACD/IUPAC Name]
2-{4-[(Z)-{[2-(4-Bromo-1H-pyrazol-1-yl)propanoyl]hydrazono}methyl]-2-methoxyphenoxy}-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)acetamide [ACD/IUPAC Name]
2-{4-[(Z)-{[2-(4-Bromo-1H-pyrazol-1-yl)propanoyl]hydrazono}méthyl]-2-méthoxyphénoxy}-N-(1,5-diméthyl-3-oxo-2-phényl-2,3-dihydro-1H-pyrazol-4-yl)acétamide [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.654
Molar Refractivity: 153.0±0.5 cm3
#H bond acceptors: 12
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 3.02
ACD/LogD (pH 5.5): 2.06
ACD/BCF (pH 5.5): 21.81
ACD/KOC (pH 5.5): 316.09
ACD/LogD (pH 7.4): 2.06
ACD/BCF (pH 7.4): 21.81
ACD/KOC (pH 7.4): 316.04
Polar Surface Area: 130 Å2
Polarizability: 60.7±0.5 10-24cm3
Surface Tension: 53.2±7.0 dyne/cm
Molar Volume: 417.5±7.0 cm3

Click to predict properties on the Chemicalize site


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