ChemSpider 2D Image | N-(3-Chlorobenzyl)-N-(1-isobutyryl-4-piperidinyl)-N~2~-[(4-methylphenyl)sulfonyl]-N~2~-propylglycinamide | C28H38ClN3O4S

N-(3-Chlorobenzyl)-N-(1-isobutyryl-4-piperidinyl)-N2-[(4-methylphenyl)sulfonyl]-N2-propylglycinamide

  • Molecular FormulaC28H38ClN3O4S
  • Average mass548.137 Da
  • Monoisotopic mass547.227173 Da
  • ChemSpider ID22779154

More details:

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

Acetamide, N-[(3-chlorophenyl)methyl]-N-[1-(2-methyl-1-oxopropyl)-4-piperidinyl]-2-[[(4-methylphenyl)sulfonyl]propylamino]- [ACD/Index Name]
N-(3-Chlorbenzyl)-N-(1-isobutyryl-4-piperidinyl)-N2-[(4-methylphenyl)sulfonyl]-N2-propylglycinamid [German] [ACD/IUPAC Name]
N-(3-Chlorobenzyl)-N-(1-isobutyryl-4-piperidinyl)-N2-[(4-methylphenyl)sulfonyl]-N2-propylglycinamide [ACD/IUPAC Name]
N-(3-Chlorobenzyl)-N-(1-isobutyryl-4-pipéridinyl)-N2-[(4-méthylphényl)sulfonyl]-N2-propylglycinamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 708.5±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 103.6±3.0 kJ/mol
Flash Point: 382.3±35.7 °C
Index of Refraction: 1.601
Molar Refractivity: 149.0±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 5.75
ACD/LogD (pH 5.5): 4.91
ACD/BCF (pH 5.5): 3168.34
ACD/KOC (pH 5.5): 11155.53
ACD/LogD (pH 7.4): 4.91
ACD/BCF (pH 7.4): 3168.34
ACD/KOC (pH 7.4): 11155.53
Polar Surface Area: 86 Å2
Polarizability: 59.1±0.5 10-24cm3
Surface Tension: 55.9±5.0 dyne/cm
Molar Volume: 434.9±5.0 cm3

Click to predict properties on the Chemicalize site


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