ChemSpider 2D Image | Deferitazole | C18H25NO7S

Deferitazole

  • Molecular FormulaC18H25NO7S
  • Average mass399.459 Da
  • Monoisotopic mass399.135162 Da
  • ChemSpider ID23330184

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(4S)-2-(2-Hydroxy-3-{2-[2-(2-methoxyethoxy)ethoxy]ethoxy}phenyl)-4-methyl-4,5-dihydro-1,3-thiazol-4-carbonsäure [German] [ACD/IUPAC Name]
(4S)-2-(2-Hydroxy-3-{2-[2-(2-methoxyethoxy)ethoxy]ethoxy}phenyl)-4-methyl-4,5-dihydro-1,3-thiazole-4-carboxylic acid [ACD/IUPAC Name]
4D8DC53Y1L
4-Thiazolecarboxylic acid, 4,5-dihydro-2-[2-hydroxy-3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-4-methyl-, (4S)- [ACD/Index Name]
945635-15-4 [RN]
Acide (4S)-2-(2-hydroxy-3-{2-[2-(2-méthoxyéthoxy)éthoxy]éthoxy}phényl)-4-méthyl-4,5-dihydro-1,3-thiazole-4-carboxylique [French] [ACD/IUPAC Name]
deferitazol [Spanish] [INN]
Deferitazole [INN] [USAN]
déféritazole [French] [INN]
deferitazolum [Latin] [INN]
More...

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

9659 [DBID]
FBS0701 [DBID]
SPD602 [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: 584.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 91.9±3.0 kJ/mol
Flash Point: 307.4±32.9 °C
Index of Refraction: 1.564
Molar Refractivity: 99.5±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 0
ACD/LogP: -0.76
ACD/LogD (pH 5.5): -1.23
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.90
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 132 Å2
Polarizability: 39.5±0.5 10-24cm3
Surface Tension: 47.4±7.0 dyne/cm
Molar Volume: 305.9±7.0 cm3

Click to predict properties on the Chemicalize site


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