ChemSpider 2D Image | (S)-Reglitazar | C22H20N2O5

(S)-Reglitazar

  • Molecular FormulaC22H20N2O5
  • Average mass392.405 Da
  • Monoisotopic mass392.137207 Da
  • ChemSpider ID34993026

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(4S)-4-{4-[2-(5-Methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]benzyl}-1,2-oxazolidin-3,5-dion [German] [ACD/IUPAC Name]
(4S)-4-{4-[2-(5-Methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]benzyl}-1,2-oxazolidine-3,5-dione [ACD/IUPAC Name]
(4S)-4-{4-[2-(5-Méthyl-2-phényl-1,3-oxazol-4-yl)éthoxy]benzyl}-1,2-oxazolidine-3,5-dione [French] [ACD/IUPAC Name]
(S)-Reglitazar
1029132-99-7 [RN]
3,5-Isoxazolidinedione, 4-[[4-[2-(5-methyl-2-phenyl-4-oxazolyl)ethoxy]phenyl]methyl]-, (4S)- [ACD/Index Name]
170861-63-9 [RN]
reglitazar [INN]
REGLITAZAR, (S)-
UNII-P9UTN18JVV

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

05GV66DCBS [DBID]
UNII:05GV66DCBS [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.594
Molar Refractivity: 103.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.69
ACD/LogD (pH 5.5): 2.74
ACD/BCF (pH 5.5): 71.59
ACD/KOC (pH 5.5): 740.15
ACD/LogD (pH 7.4): 2.74
ACD/BCF (pH 7.4): 71.59
ACD/KOC (pH 7.4): 740.16
Polar Surface Area: 91 Å2
Polarizability: 41.2±0.5 10-24cm3
Surface Tension: 52.9±3.0 dyne/cm
Molar Volume: 305.9±3.0 cm3

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