ChemSpider 2D Image | N-{3-[(4-Benzyl-1-piperidinyl)carbonyl]-6-(2-methyl-2-propanyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-4-chlorobenzamide | C32H37ClN2O2S

N-{3-[(4-Benzyl-1-piperidinyl)carbonyl]-6-(2-methyl-2-propanyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-4-chlorobenzamide

  • Molecular FormulaC32H37ClN2O2S
  • Average mass549.166 Da
  • Monoisotopic mass548.226440 Da
  • ChemSpider ID3554796

More details:

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

Benzamide, 4-chloro-N-[6-(1,1-dimethylethyl)-4,5,6,7-tetrahydro-3-[[4-(phenylmethyl)-1-piperidinyl]carbonyl]benzo[b]thien-2-yl]- [ACD/Index Name]
N-{3-[(4-Benzyl-1-piperidinyl)carbonyl]-6-(2-methyl-2-propanyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-4-chlorbenzamid [German] [ACD/IUPAC Name]
N-{3-[(4-Benzyl-1-piperidinyl)carbonyl]-6-(2-methyl-2-propanyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-4-chlorobenzamide [ACD/IUPAC Name]
N-{3-[(4-Benzyl-1-pipéridinyl)carbonyl]-6-(2-méthyl-2-propanyl)-4,5,6,7-tétrahydro-1-benzothiophén-2-yl}-4-chlorobenzamide [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: 653.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.2±3.0 kJ/mol
Flash Point: 348.8±31.5 °C
Index of Refraction: 1.628
Molar Refractivity: 158.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 9.59
ACD/LogD (pH 5.5): 8.31
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 794337.13
ACD/LogD (pH 7.4): 8.31
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 794332.75
Polar Surface Area: 78 Å2
Polarizability: 62.7±0.5 10-24cm3
Surface Tension: 53.6±3.0 dyne/cm
Molar Volume: 446.2±3.0 cm3

Click to predict properties on the Chemicalize site


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