ChemSpider 2D Image | 3-[(3,4-Dimethoxyphenyl)sulfonyl]-N-[1-(3,5-dimethyl-1-piperidinyl)-3-(4-fluorophenyl)-1-oxo-2-propanyl]propanamide | C27H35FN2O6S

3-[(3,4-Dimethoxyphenyl)sulfonyl]-N-[1-(3,5-dimethyl-1-piperidinyl)-3-(4-fluorophenyl)-1-oxo-2-propanyl]propanamide

  • Molecular FormulaC27H35FN2O6S
  • Average mass534.640 Da
  • Monoisotopic mass534.219971 Da
  • ChemSpider ID121942611

More details:

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

3-[(3,4-Dimethoxyphenyl)sulfonyl]-N-[1-(3,5-dimethyl-1-piperidinyl)-3-(4-fluorophenyl)-1-oxo-2-propanyl]propanamide [ACD/IUPAC Name]
3-[(3,4-Diméthoxyphényl)sulfonyl]-N-[1-(3,5-diméthyl-1-pipéridinyl)-3-(4-fluorophényl)-1-oxo-2-propanyl]propanamide [French] [ACD/IUPAC Name]
3-[(3,4-Dimethoxyphenyl)sulfonyl]-N-[1-(3,5-dimethyl-1-piperidinyl)-3-(4-fluorphenyl)-1-oxo-2-propanyl]propanamid [German] [ACD/IUPAC Name]
Propanamide, 3-[(3,4-dimethoxyphenyl)sulfonyl]-N-[2-(3,5-dimethyl-1-piperidinyl)-1-[(4-fluorophenyl)methyl]-2-oxoethyl]- [ACD/Index 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: 767.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 111.7±3.0 kJ/mol
Flash Point: 417.8±32.9 °C
Index of Refraction: 1.544
Molar Refractivity: 139.0±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 4.41
ACD/LogD (pH 5.5): 3.18
ACD/BCF (pH 5.5): 154.74
ACD/KOC (pH 5.5): 1285.04
ACD/LogD (pH 7.4): 3.18
ACD/BCF (pH 7.4): 154.74
ACD/KOC (pH 7.4): 1285.04
Polar Surface Area: 110 Å2
Polarizability: 55.1±0.5 10-24cm3
Surface Tension: 43.7±3.0 dyne/cm
Molar Volume: 440.2±3.0 cm3

Click to predict properties on the Chemicalize site


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