ChemSpider 2D Image | 3-[(3-Chloro-4-methoxyphenyl)sulfonyl]-N-[1-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-3-(4-hydroxyphenyl)-1-oxo-2-propanyl]propanamide | C26H31ClN2O8S

3-[(3-Chloro-4-methoxyphenyl)sulfonyl]-N-[1-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-3-(4-hydroxyphenyl)-1-oxo-2-propanyl]propanamide

  • Molecular FormulaC26H31ClN2O8S
  • Average mass567.051 Da
  • Monoisotopic mass566.148987 Da
  • ChemSpider ID121661250

More details:

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

3-[(3-Chlor-4-methoxyphenyl)sulfonyl]-N-[1-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-3-(4-hydroxyphenyl)-1-oxo-2-propanyl]propanamid [German] [ACD/IUPAC Name]
3-[(3-Chloro-4-methoxyphenyl)sulfonyl]-N-[1-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-3-(4-hydroxyphenyl)-1-oxo-2-propanyl]propanamide [ACD/IUPAC Name]
3-[(3-Chloro-4-méthoxyphényl)sulfonyl]-N-[1-(1,4-dioxa-8-azaspiro[4.5]déc-8-yl)-3-(4-hydroxyphényl)-1-oxo-2-propanyl]propanamide [French] [ACD/IUPAC Name]
Propanamide, 3-[(3-chloro-4-methoxyphenyl)sulfonyl]-N-[2-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-1-[(4-hydroxyphenyl)methyl]-2-oxoethyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 877.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 131.9±3.0 kJ/mol
Flash Point: 484.5±34.3 °C
Index of Refraction: 1.632
Molar Refractivity: 140.4±0.4 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 2.70
ACD/LogD (pH 5.5): 2.54
ACD/BCF (pH 5.5): 50.28
ACD/KOC (pH 5.5): 574.71
ACD/LogD (pH 7.4): 2.54
ACD/BCF (pH 7.4): 50.08
ACD/KOC (pH 7.4): 572.48
Polar Surface Area: 140 Å2
Polarizability: 55.6±0.5 10-24cm3
Surface Tension: 68.1±5.0 dyne/cm
Molar Volume: 393.3±5.0 cm3

Click to predict properties on the Chemicalize site


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