ChemSpider 2D Image | 2-Methyl-2-propanyl 4-{[(2Z)-2-(2-bromo-5-methoxy-4-{2-[(4-methylphenyl)amino]-2-oxoethoxy}benzylidene)hydrazino]carbonyl}-1-piperidinecarboxylate | C28H35BrN4O6

2-Methyl-2-propanyl 4-{[(2Z)-2-(2-bromo-5-methoxy-4-{2-[(4-methylphenyl)amino]-2-oxoethoxy}benzylidene)hydrazino]carbonyl}-1-piperidinecarboxylate

  • Molecular FormulaC28H35BrN4O6
  • Average mass603.505 Da
  • Monoisotopic mass602.174011 Da
  • ChemSpider ID101733501

  • Double-bond stereo - Double-bond stereo

More details:

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

1,4-Piperidinedicarboxylic acid, 1-(1,1-dimethylethyl) ester, 4-[2-[(1Z)-[2-bromo-5-methoxy-4-[2-[(4-methylphenyl)amino]-2-oxoethoxy]phenyl]methylene]hydrazide] [ACD/Index Name]
2-Methyl-2-propanyl 4-{[(2Z)-2-(2-bromo-5-methoxy-4-{2-[(4-methylphenyl)amino]-2-oxoethoxy}benzylidene)hydrazino]carbonyl}-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-{[(2Z)-2-(2-brom-5-methoxy-4-{2-[(4-methylphenyl)amino]-2-oxoethoxy}benzyliden)hydrazino]carbonyl}-1-piperidincarboxylat [German] [ACD/IUPAC Name]
4-{[(2Z)-2-(2-Bromo-5-méthoxy-4-{2-[(4-méthylphényl)amino]-2-oxoéthoxy}benzylidène)hydrazino]carbonyl}-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [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: 1.591
Molar Refractivity: 151.0±0.5 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: 5.73
ACD/LogD (pH 5.5): 4.86
ACD/BCF (pH 5.5): 2926.04
ACD/KOC (pH 5.5): 10537.95
ACD/LogD (pH 7.4): 4.86
ACD/BCF (pH 7.4): 2926.09
ACD/KOC (pH 7.4): 10538.10
Polar Surface Area: 119 Å2
Polarizability: 59.8±0.5 10-24cm3
Surface Tension: 45.4±7.0 dyne/cm
Molar Volume: 446.9±7.0 cm3

Click to predict properties on the Chemicalize site


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