ChemSpider 2D Image | N~2~-(Ethylsulfonyl)-N~2~-isobutyl-N-[1-(2-methoxybenzoyl)-4-piperidinyl]-N-(4-methylbenzyl)glycinamide | C29H41N3O5S

N2-(Ethylsulfonyl)-N2-isobutyl-N-[1-(2-methoxybenzoyl)-4-piperidinyl]-N-(4-methylbenzyl)glycinamide

  • Molecular FormulaC29H41N3O5S
  • Average mass543.718 Da
  • Monoisotopic mass543.276672 Da
  • ChemSpider ID22779409

More details:

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

Acetamide, 2-[(ethylsulfonyl)(2-methylpropyl)amino]-N-[1-(2-methoxybenzoyl)-4-piperidinyl]-N-[(4-methylphenyl)methyl]- [ACD/Index Name]
N2-(Ethylsulfonyl)-N2-isobutyl-N-[1-(2-methoxybenzoyl)-4-piperidinyl]-N-(4-methylbenzyl)glycinamid [German] [ACD/IUPAC Name]
N2-(Ethylsulfonyl)-N2-isobutyl-N-[1-(2-methoxybenzoyl)-4-piperidinyl]-N-(4-methylbenzyl)glycinamide [ACD/IUPAC Name]
N2-(Éthylsulfonyl)-N2-isobutyl-N-[1-(2-méthoxybenzoyl)-4-pipéridinyl]-N-(4-méthylbenzyl)glycinamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 716.0±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.6±3.0 kJ/mol
Flash Point: 386.8±35.7 °C
Index of Refraction: 1.590
Molar Refractivity: 150.5±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 4.26
ACD/LogD (pH 5.5): 3.82
ACD/BCF (pH 5.5): 469.17
ACD/KOC (pH 5.5): 2842.75
ACD/LogD (pH 7.4): 3.82
ACD/BCF (pH 7.4): 469.17
ACD/KOC (pH 7.4): 2842.75
Polar Surface Area: 96 Å2
Polarizability: 59.7±0.5 10-24cm3
Surface Tension: 54.5±5.0 dyne/cm
Molar Volume: 445.7±5.0 cm3

Click to predict properties on the Chemicalize site


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