ChemSpider 2D Image | 2,5-Anhydro-4,6-dideoxy-6-{[(4-methoxyphenyl)sulfonyl]amino}-4-(4-methyl-1-piperidinyl)-D-galactitol | C19H30N2O6S

2,5-Anhydro-4,6-dideoxy-6-{[(4-methoxyphenyl)sulfonyl]amino}-4-(4-methyl-1-piperidinyl)-D-galactitol

  • Molecular FormulaC19H30N2O6S
  • Average mass414.516 Da
  • Monoisotopic mass414.182465 Da
  • ChemSpider ID22807458

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

2,5-Anhydro-4,6-dideoxy-6-{[(4-methoxyphenyl)sulfonyl]amino}-4-(4-methyl-1-piperidinyl)-D-galactitol [ACD/IUPAC Name]
2,5-Anhydro-4,6-didesoxy-6-{[(4-methoxyphenyl)sulfonyl]amino}-4-(4-methyl-1-piperidinyl)-D-galactitol [German] [ACD/IUPAC Name]
2,5-Anhydro-4,6-didésoxy-6-{[(4-méthoxyphényl)sulfonyl]amino}-4-(4-méthyl-1-pipéridinyl)-D-galactitol [French] [ACD/IUPAC Name]
D-Galactitol, 2,5-anhydro-4,6-dideoxy-6-[[(4-methoxyphenyl)sulfonyl]amino]-4-(4-methyl-1-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: 604.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 94.5±3.0 kJ/mol
Flash Point: 319.4±34.3 °C
Index of Refraction: 1.560
Molar Refractivity: 105.7±0.4 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.27
ACD/LogD (pH 5.5): -0.77
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.94
ACD/BCF (pH 7.4): 2.15
ACD/KOC (pH 7.4): 39.79
Polar Surface Area: 117 Å2
Polarizability: 41.9±0.5 10-24cm3
Surface Tension: 48.7±3.0 dyne/cm
Molar Volume: 326.5±3.0 cm3

Click to predict properties on the Chemicalize site


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