ChemSpider 2D Image | AGN-201904 | C25H25N3O8S2

AGN-201904

  • Molecular FormulaC25H25N3O8S2
  • Average mass559.611 Da
  • Monoisotopic mass559.108276 Da
  • ChemSpider ID8004989

More details:

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

{4-[(5-Methoxy-2-{[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl}-1H-benzimidazol-1-yl)sulfonyl]phenoxy}acetic acid [ACD/IUPAC Name]
{4-[(5-Methoxy-2-{[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl}-1H-benzimidazol-1-yl)sulfonyl]phenoxy}essigsäure [German] [ACD/IUPAC Name]
651729-53-2 [RN]
Acetic acid, 2-[4-[[5-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl]-1H-benzimidazol-1-yl]sulfonyl]phenoxy]- [ACD/Index Name]
Acide {4-[(5-méthoxy-2-{[(4-méthoxy-3,5-diméthyl-2-pyridinyl)méthyl]sulfinyl}-1H-benzimidazol-1-yl)sulfonyl]phénoxy}acétique [French] [ACD/IUPAC Name]
AGN-201904
G0835O03ZM
UNII:G0835O03ZM
2-[4-[5-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfinyl]benzimidazol-1-yl]sulfonylphenoxy]acetic acid
Acetic acid, 2-(4-((5-methoxy-2-(((4-methoxy-3,5-dimethyl-2-pyridinyl)methyl)sulfinyl)-1H-benzimidazol-1-yl)sulfonyl)phenoxy)-
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point: 822.9±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 125.4±3.0 kJ/mol
Flash Point: 451.5±37.1 °C
Index of Refraction: 1.665
Molar Refractivity: 141.3±0.5 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 2.80
ACD/LogD (pH 5.5): -0.50
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.58
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 175 Å2
Polarizability: 56.0±0.5 10-24cm3
Surface Tension: 60.1±7.0 dyne/cm
Molar Volume: 380.5±7.0 cm3

Click to predict properties on the Chemicalize site


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