Substance
- Substance Name: Istradefylline
- Formula: C20H24N4O4
- Molecular Weight: 384.4 g/mol
- Identifiers:
- inchi: InChI=1S/C20H24N4O4/c1-6-23-18-17(19(25)24(7-2)20(23)26)22(3)16(21-18)11-9-13-8-10-14(27-4)15(12-13)28-5/h8-12H,6-7H2,1-5H3/b11-9+
- inchikey: IQVRBWUUXZMOPW-PKNBQFBNSA-N
- casrn: 155270-99-8
- csmiles: CCN1C2=C(C(=O)N(C1=O)CC)N(C(=N2)C=CC3=CC(=C(C=C3)OC)OC)C
- ismiles: CCN1C2=C(C(=O)N(C1=O)CC)N(C(=N2)/C=C/C3=CC(=C(C=C3)OC)OC)C
- pubchemId: 5311037
- iupacname: 8-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-1,3-diethyl-7-methylpurine-2,6-dione
- wikidataId: Q905783
- chemspiderId: 4470574
- dsstoxcmpId: DTXCID8031441
- chemblId: CHEMBL431770
- ecnumber: 803-302-8
Istradefylline
Systems and Datasets
- propan-2-ol + ethyl acetate + Istradefylline (Datasets: 1)
- Dataset 1 in paper 10.1016/j.jct.2017.03.015 (Dataseries: 8, Datapoints: 96, Quantity: Mole fraction)
- tetrahydrofuran + ethyl acetate + Istradefylline (Datasets: 1)
- Dataset 2 in paper 10.1016/j.jct.2017.03.015 (Dataseries: 8, Datapoints: 96, Quantity: Mole fraction)
- acetone + ethyl acetate + Istradefylline (Datasets: 1)
- Dataset 3 in paper 10.1016/j.jct.2017.03.015 (Dataseries: 8, Datapoints: 96, Quantity: Mole fraction)
- ethyl acetate + Istradefylline (Datasets: 1)
- Dataset 4 in paper 10.1016/j.jct.2017.03.015 (Dataseries: 1, Datapoints: 12, Quantity: Mole fraction)
- propan-2-ol + Istradefylline (Datasets: 1)
- Dataset 5 in paper 10.1016/j.jct.2017.03.015 (Dataseries: 1, Datapoints: 12, Quantity: Mole fraction)
- tetrahydrofuran + Istradefylline (Datasets: 1)
- Dataset 6 in paper 10.1016/j.jct.2017.03.015 (Dataseries: 1, Datapoints: 12, Quantity: Mole fraction)
- acetone + Istradefylline (Datasets: 1)
- Dataset 7 in paper 10.1016/j.jct.2017.03.015 (Dataseries: 1, Datapoints: 12, Quantity: Mole fraction)