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Istradefylline

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Istradefylline / CAS : 155270-99-8

Appearance white to beige. powder UN 2811
HS 0.0 DG Class 3
Synonyms 8-[(E)-2-(3,4-Dimethoxyphenyl)Ethenyl]-1,3-Diethyl-7-Methyl-Purine-2,6-Dione; Itraphylline; 8-[(1E)-2-(2-(3,4-Dimethoxyphenyl)Ethenyl]-1,3-Diethyl-3,7-Dihydro-7-Methyl-1H-Purine-2,6-Dione
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Properties

Summary

Formula
C20H24N4O4
Molecular Mass
384.42900
Exact Mass
384.18000
PSA
80.28000
Logp
2.12410
IUPAC
8-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-1,3-diethyl-7-methylpurine-2,6-dione
SMILES
CCN1C2=C(C(=O)N(C1=O)CC)N(C(=N2)/C=C/C3=CC(=C(C=C3)OC)OC)C

Attribute classification

Category
API & Intermediate > Nervous System Drugs

Chemical and Physical Properties

Melting Point
191 °C
Density
1.24g/cm3
Boiling Point
601ºC at 760mmHg
Flash Point
317.3ºC
Appearance
white to beige. powder

Export information

HS Code
0.0
UN No.
2811
DG-Class
3
Risk Code
25
Safety Label
T

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