ChemSpider 2D Image | Ethyl 4-({[1-(6-phenoxy-4-pyrimidinyl)-4-piperidinyl]carbonyl}amino)-1-piperidinecarboxylate | C24H31N5O4

Ethyl 4-({[1-(6-phenoxy-4-pyrimidinyl)-4-piperidinyl]carbonyl}amino)-1-piperidinecarboxylate

  • Molecular FormulaC24H31N5O4
  • Average mass453.534 Da
  • Monoisotopic mass453.237610 Da
  • ChemSpider ID26317231

More details:

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

1-Piperidinecarboxylic acid, 4-[[[1-(6-phenoxy-4-pyrimidinyl)-4-piperidinyl]carbonyl]amino]-, ethyl ester [ACD/Index Name]
4-({[1-(6-Phénoxy-4-pyrimidinyl)-4-pipéridinyl]carbonyl}amino)-1-pipéridinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4-({[1-(6-phenoxy-4-pyrimidinyl)-4-piperidinyl]carbonyl}amino)-1-piperidinecarboxylate [ACD/IUPAC Name]
Ethyl-4-({[1-(6-phenoxy-4-pyrimidinyl)-4-piperidinyl]carbonyl}amino)-1-piperidincarboxylat [German] [ACD/IUPAC Name]
[1115923-16-4] [RN]
1115923-16-4 [RN]
4-{[1-(6-Phenoxy-pyrimidin-4-yl)-piperidine-4-carbonyl]-amino}-piperidine-1-carboxylic acid ethyl ester
ethyl 4-({[1-(6-phenoxypyrimidin-4-yl)piperidin-4-yl]carbonyl}amino)piperidine-1-carboxylate
ethyl 4-(1-(6-phenoxypyrimidin-4-yl)piperidine-4-carboxamido)piperidine-1-carboxylate
ethyl 4-[[1-(6-phenoxypyrimidin-4-yl)piperidine-4-carbonyl]amino]piperidine-1-carboxylate
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 681.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.0±3.0 kJ/mol
Flash Point: 366.0±31.5 °C
Index of Refraction: 1.613
Molar Refractivity: 122.9±0.4 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.77
ACD/LogD (pH 5.5): 2.44
ACD/BCF (pH 5.5): 34.63
ACD/KOC (pH 5.5): 347.38
ACD/LogD (pH 7.4): 2.80
ACD/BCF (pH 7.4): 78.32
ACD/KOC (pH 7.4): 785.63
Polar Surface Area: 97 Å2
Polarizability: 48.7±0.5 10-24cm3
Surface Tension: 63.4±5.0 dyne/cm
Molar Volume: 353.2±5.0 cm3

Click to predict properties on the Chemicalize site


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