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ChemSpider 2D Image | gliquidone | C27H33N3O6S


  • Molecular FormulaC27H33N3O6S
  • Average mass527.632 Da
  • Monoisotopic mass527.208984 Da
  • ChemSpider ID82719

More details:

Featured data source

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

251-463-2 [EINECS]
33342-05-1 [RN]
Benzenesulfonamide, N-[(cyclohexylamino)carbonyl]-4-[2-(3,4-dihydro-7-methoxy-4,4-dimethyl-1,3-dioxo-2(1H)-isoquinolinyl)ethyl]- [ACD/Index Name]
gliquidone [Wiki]
MFCD00631870 [MDL number]
N-(Cyclohexylcarbamoyl)-4-[2-(7-methoxy-4,4-dimethyl-1,3-dioxo-3,4-dihydro-2(1H)-isochinolinyl)ethyl]benzolsulfonamid [German] [ACD/IUPAC Name]
N-(Cyclohexylcarbamoyl)-4-[2-(7-méthoxy-4,4-diméthyl-1,3-dioxo-3,4-dihydro-2(1H)-isoquinoléinyl)éthyl]benzènesulfonamide [French] [ACD/IUPAC Name]

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

BRN 1559726 [DBID]
D02430 [DBID]
NCGC00016819-01 [DBID]
Prestwick0_000991 [DBID]
Prestwick1_000991 [DBID]
SPBio_002972 [DBID]
ZINC01482077 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.624
Molar Refractivity: 138.9±0.4 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 3.11
ACD/LogD (pH 5.5): 2.62
ACD/BCF (pH 5.5): 34.86
ACD/KOC (pH 5.5): 244.53
ACD/LogD (pH 7.4): 1.59
ACD/BCF (pH 7.4): 3.26
ACD/KOC (pH 7.4): 22.86
Polar Surface Area: 130 Å2
Polarizability: 55.1±0.5 10-24cm3
Surface Tension: 62.7±5.0 dyne/cm
Molar Volume: 393.3±5.0 cm3

Click to predict properties on the Chemicalize site