ChemSpider 2D Image | {3-[2-(2-Methoxyphenoxy)ethyl]-1-pyrrolidinyl}{1-[(4-methyl-1-piperidinyl)sulfonyl]-4-piperidinyl}methanone | C25H39N3O5S

{3-[2-(2-Methoxyphenoxy)ethyl]-1-pyrrolidinyl}{1-[(4-methyl-1-piperidinyl)sulfonyl]-4-piperidinyl}methanone

  • Molecular FormulaC25H39N3O5S
  • Average mass493.659 Da
  • Monoisotopic mass493.261047 Da
  • ChemSpider ID44229198

More details:

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

{3-[2-(2-Methoxyphenoxy)ethyl]-1-pyrrolidinyl}{1-[(4-methyl-1-piperidinyl)sulfonyl]-4-piperidinyl}methanon [German] [ACD/IUPAC Name]
{3-[2-(2-Methoxyphenoxy)ethyl]-1-pyrrolidinyl}{1-[(4-methyl-1-piperidinyl)sulfonyl]-4-piperidinyl}methanone [ACD/IUPAC Name]
{3-[2-(2-Méthoxyphénoxy)éthyl]-1-pyrrolidinyl}{1-[(4-méthyl-1-pipéridinyl)sulfonyl]-4-pipéridinyl}méthanone [French] [ACD/IUPAC Name]
Methanone, [3-[2-(2-methoxyphenoxy)ethyl]-1-pyrrolidinyl][1-[(4-methyl-1-piperidinyl)sulfonyl]-4-piperidinyl]- [ACD/Index 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: 651.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 96.0±3.0 kJ/mol
Flash Point: 347.6±28.7 °C
Index of Refraction: 1.591
Molar Refractivity: 132.6±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.06
ACD/LogD (pH 5.5): 2.22
ACD/BCF (pH 5.5): 28.84
ACD/KOC (pH 5.5): 386.08
ACD/LogD (pH 7.4): 2.22
ACD/BCF (pH 7.4): 28.84
ACD/KOC (pH 7.4): 386.08
Polar Surface Area: 88 Å2
Polarizability: 52.6±0.5 10-24cm3
Surface Tension: 56.0±5.0 dyne/cm
Molar Volume: 392.3±5.0 cm3

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