ChemSpider 2D Image | 4-[2-({3-[(3-Chloro-4-methoxyphenyl)sulfonyl]propanoyl}amino)-3-(4-hydroxy-1-piperidinyl)-3-oxopropyl]phenyl acetate | C26H31ClN2O8S

4-[2-({3-[(3-Chloro-4-methoxyphenyl)sulfonyl]propanoyl}amino)-3-(4-hydroxy-1-piperidinyl)-3-oxopropyl]phenyl acetate

  • Molecular FormulaC26H31ClN2O8S
  • Average mass567.051 Da
  • Monoisotopic mass566.148987 Da
  • ChemSpider ID121664978

More details:

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

4-[2-({3-[(3-Chlor-4-methoxyphenyl)sulfonyl]propanoyl}amino)-3-(4-hydroxy-1-piperidinyl)-3-oxopropyl]phenyl-acetat [German] [ACD/IUPAC Name]
4-[2-({3-[(3-Chloro-4-methoxyphenyl)sulfonyl]propanoyl}amino)-3-(4-hydroxy-1-piperidinyl)-3-oxopropyl]phenyl acetate [ACD/IUPAC Name]
Acétate de 4-[2-({3-[(3-chloro-4-méthoxyphényl)sulfonyl]propanoyl}amino)-3-(4-hydroxy-1-pipéridinyl)-3-oxopropyl]phényle [French] [ACD/IUPAC Name]
Propanamide, N-[1-[[4-(acetyloxy)phenyl]methyl]-2-(4-hydroxy-1-piperidinyl)-2-oxoethyl]-3-[(3-chloro-4-methoxyphenyl)sulfonyl]- [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: 855.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 130.2±3.0 kJ/mol
Flash Point: 471.0±34.3 °C
Index of Refraction: 1.587
Molar Refractivity: 140.7±0.4 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 2.09
ACD/LogD (pH 5.5): 2.10
ACD/BCF (pH 5.5): 23.02
ACD/KOC (pH 5.5): 328.55
ACD/LogD (pH 7.4): 2.10
ACD/BCF (pH 7.4): 23.02
ACD/KOC (pH 7.4): 328.55
Polar Surface Area: 148 Å2
Polarizability: 55.8±0.5 10-24cm3
Surface Tension: 56.2±3.0 dyne/cm
Molar Volume: 418.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement