ChemSpider 2D Image | N-{1-[(Benzyloxy)acetyl]-4-piperidinyl}-N~2~-(ethylsulfonyl)-N-(2-methylbenzyl)-N~2~-propylglycinamide | C29H41N3O5S

N-{1-[(Benzyloxy)acetyl]-4-piperidinyl}-N2-(ethylsulfonyl)-N-(2-methylbenzyl)-N2-propylglycinamide

  • Molecular FormulaC29H41N3O5S
  • Average mass543.718 Da
  • Monoisotopic mass543.276672 Da
  • ChemSpider ID22789751

More details:

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

Acetamide, 2-[(ethylsulfonyl)propylamino]-N-[(2-methylphenyl)methyl]-N-[1-[2-(phenylmethoxy)acetyl]-4-piperidinyl]- [ACD/Index Name]
N-{1-[(Benzyloxy)acetyl]-4-piperidinyl}-N2-(ethylsulfonyl)-N-(2-methylbenzyl)-N2-propylglycinamid [German] [ACD/IUPAC Name]
N-{1-[(Benzyloxy)acetyl]-4-piperidinyl}-N2-(ethylsulfonyl)-N-(2-methylbenzyl)-N2-propylglycinamide [ACD/IUPAC Name]
N-{1-[2-(Benzyloxy)acétyl]-4-pipéridinyl}-N2-(éthylsulfonyl)-N-(2-méthylbenzyl)-N2-propylglycinamide [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: 715.7±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: 386.7±35.7 °C
Index of Refraction: 1.591
Molar Refractivity: 150.6±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 1
ACD/LogP: 4.98
ACD/LogD (pH 5.5): 4.07
ACD/BCF (pH 5.5): 726.51
ACD/KOC (pH 5.5): 3887.57
ACD/LogD (pH 7.4): 4.07
ACD/BCF (pH 7.4): 726.51
ACD/KOC (pH 7.4): 3887.57
Polar Surface Area: 96 Å2
Polarizability: 59.7±0.5 10-24cm3
Surface Tension: 55.2±5.0 dyne/cm
Molar Volume: 445.6±5.0 cm3

Click to predict properties on the Chemicalize site


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