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ChemSpider 2D Image | Ethyl 4-(4-benzoyl-1-piperazinyl)-3-{[(1-naphthyloxy)acetyl]amino}benzoate | C32H31N3O5

Ethyl 4-(4-benzoyl-1-piperazinyl)-3-{[(1-naphthyloxy)acetyl]amino}benzoate

  • Molecular FormulaC32H31N3O5
  • Average mass537.606 Da
  • Monoisotopic mass537.226379 Da
  • ChemSpider ID12716929

More details:

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

4-(4-Benzoyl-1-pipérazinyl)-3-{[2-(1-naphtyloxy)acétyl]amino}benzoate d'éthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-(4-benzoyl-1-piperazinyl)-3-[[2-(1-naphthalenyloxy)acetyl]amino]-, ethyl ester [ACD/Index Name]
Ethyl 4-(4-benzoyl-1-piperazinyl)-3-{[(1-naphthyloxy)acetyl]amino}benzoate [ACD/IUPAC Name]
Ethyl 4-(4-benzoylpiperazin-1-yl)-3-{[(1-naphthyloxy)acetyl]amino}benzoate
ethyl 4-(4-benzoylpiperazin-1-yl)-3-{[(naphthalen-1-yloxy)acetyl]amino}benzoate
Ethyl-4-(4-benzoyl-1-piperazinyl)-3-{[(1-naphthyloxy)acetyl]amino}benzoat [German] [ACD/IUPAC Name]
4-(4-Benzoyl-piperazin-1-yl)-3-[2-(naphthalen-1-yloxy)-acetylamino]-benzoic acid ethyl ester
765919-47-9 [RN]
benzoic acid, 4-(4-benzoyl-1-piperazinyl)-3-[[(1-naphthalenyloxy)acetyl]amino]-, ethyl ester
ethyl 3-{[(naphthalen-1-yloxy)acetyl]amino}-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 797.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 115.9±3.0 kJ/mol
Flash Point: 436.0±32.9 °C
Index of Refraction: 1.657
Molar Refractivity: 154.4±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 4.29
ACD/LogD (pH 5.5): 4.86
ACD/BCF (pH 5.5): 2891.45
ACD/KOC (pH 5.5): 10437.29
ACD/LogD (pH 7.4): 4.86
ACD/BCF (pH 7.4): 2902.43
ACD/KOC (pH 7.4): 10476.91
Polar Surface Area: 88 Å2
Polarizability: 61.2±0.5 10-24cm3
Surface Tension: 58.5±3.0 dyne/cm
Molar Volume: 419.8±3.0 cm3

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