ChemSpider 2D Image | N-{1-[(5-Chloro-2,3-dihydro-1-benzothiophen-3-yl)methyl]-4-piperidinyl}-2-(4-methoxyphenyl)-N-(4-methylbenzyl)acetamide | C31H35ClN2O2S

N-{1-[(5-Chloro-2,3-dihydro-1-benzothiophen-3-yl)methyl]-4-piperidinyl}-2-(4-methoxyphenyl)-N-(4-methylbenzyl)acetamide

  • Molecular FormulaC31H35ClN2O2S
  • Average mass535.140 Da
  • Monoisotopic mass534.210754 Da
  • ChemSpider ID8384378

More details:

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

Benzeneacetamide, N-[1-[(5-chloro-2,3-dihydrobenzo[b]thien-3-yl)methyl]-4-piperidinyl]-4-methoxy-N-[(4-methylphenyl)methyl]- [ACD/Index Name]
N-{1-[(5-Chlor-2,3-dihydro-1-benzothiophen-3-yl)methyl]-4-piperidinyl}-2-(4-methoxyphenyl)-N-(4-methylbenzyl)acetamid [German] [ACD/IUPAC Name]
N-{1-[(5-Chloro-2,3-dihydro-1-benzothiophen-3-yl)methyl]-4-piperidinyl}-2-(4-methoxyphenyl)-N-(4-methylbenzyl)acetamide [ACD/IUPAC Name]
N-{1-[(5-Chloro-2,3-dihydro-1-benzothiophén-3-yl)méthyl]-4-pipéridinyl}-2-(4-méthoxyphényl)-N-(4-méthylbenzyl)acétamide [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: 677.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.4±3.0 kJ/mol
Flash Point: 363.4±31.5 °C
Index of Refraction: 1.652
Molar Refractivity: 154.7±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 7.21
ACD/LogD (pH 5.5): 4.72
ACD/BCF (pH 5.5): 756.35
ACD/KOC (pH 5.5): 1080.72
ACD/LogD (pH 7.4): 6.35
ACD/BCF (pH 7.4): 32171.91
ACD/KOC (pH 7.4): 45969.41
Polar Surface Area: 58 Å2
Polarizability: 61.3±0.5 10-24cm3
Surface Tension: 58.8±5.0 dyne/cm
Molar Volume: 423.1±5.0 cm3

Click to predict properties on the Chemicalize site


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