ChemSpider 2D Image | 1-{2-[{3-[(4-Carbamoyl-1-piperidinyl)methyl]benzoyl}(methyl)amino]ethyl}-4-piperidinyl 2-biphenylylcarbamate | C35H43N5O4

1-{2-[{3-[(4-Carbamoyl-1-piperidinyl)methyl]benzoyl}(methyl)amino]ethyl}-4-piperidinyl 2-biphenylylcarbamate

  • Molecular FormulaC35H43N5O4
  • Average mass597.747 Da
  • Monoisotopic mass597.331482 Da
  • ChemSpider ID57580163

More details:

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

1-{2-[{3-[(4-Carbamoyl-1-piperidinyl)methyl]benzoyl}(methyl)amino]ethyl}-4-piperidinyl 2-biphenylylcarbamate [ACD/IUPAC Name]
1-{2-[{3-[(4-Carbamoyl-1-piperidinyl)methyl]benzoyl}(methyl)amino]ethyl}-4-piperidinyl-2-biphenylylcarbamat [German] [ACD/IUPAC Name]
2-Biphénylylcarbamate de 1-{2-[{3-[(4-carbamoyl-1-pipéridinyl)méthyl]benzoyl}(méthyl)amino]éthyl}-4-pipéridinyle [French] [ACD/IUPAC Name]
Carbamic acid, N-[1,1'-biphenyl]-2-yl-, 1-[2-[[3-[[4-(aminocarbonyl)-1-piperidinyl]methyl]benzoyl]methylamino]ethyl]-4-piperidinyl ester [ACD/Index Name]
1-(2-(3-((4-carbamoylpiperidin-1-yl)methyl)-N-methylbenzamido)ethyl)piperidin-4-yl [1,1'-biphenyl]-2-ylcarbamate
864750-70-9 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 778.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 113.4±3.0 kJ/mol
Flash Point: 424.9±32.9 °C
Index of Refraction: 1.645
Molar Refractivity: 171.8±0.4 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 3.22
ACD/LogD (pH 5.5): 0.23
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 3.18
ACD/BCF (pH 7.4): 109.19
ACD/KOC (pH 7.4): 666.41
Polar Surface Area: 108 Å2
Polarizability: 68.1±0.5 10-24cm3
Surface Tension: 63.7±5.0 dyne/cm
Molar Volume: 473.9±5.0 cm3

Click to predict properties on the Chemicalize site


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