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220847-86-9

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220847-86-9 Structure

220847-86-9 Structure
IdentificationBack Directory
[Name]

Valategrast
[CAS]

220847-86-9
[Synonyms]

Valategrast
R-411 free base
Valategrast (R411)
L-Phenylalanine, N-(2-chloro-6-methylbenzoyl)-4-[(2,6-dichlorobenzoyl)amino]-, 2-(diethylamino)ethyl ester
[Molecular Formula]

C30H32Cl3N3O4
[MDL Number]

MFCD18782681
[MOL File]

220847-86-9.mol
[Molecular Weight]

604.95
Chemical PropertiesBack Directory
[Boiling point ]

681.670±55.00 °C(Press: 760.00 Torr)(predicted)
[density ]

1.302±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
[storage temp. ]

-80°C, stored under nitrogen
[solubility ]

DMSO : 170 mg/mL (281.01 mM; Need ultrasonic)
[form ]

Solid
[pka]

11.919±0.70(predicted)
[color ]

Off-white to light yellow
Hazard InformationBack Directory
[Uses]

Treatment of asthma (dual α4β1/α4β7 integrin antagonist).
[storage]

-80°C, stored under nitrogen
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