For research use only. Not for therapeutic Use.
| Catalog Number | R032461 |
| CAS Number | 2016-63-9 |
| Synonyms | 8012CB; 8102 CB; 8’-Benzyl-7-(2-[ethyl(2-hydroxyethyl)amino]ethyl)theophylline; Bamiphylline; Benzetamophylline; Benzethamophylline |
| Molecular Formula | C20H27N5O3 |
| Purity | ≥95% |
| Storage | -20°C |
| IUPAC Name | 8-benzyl-7-[2-[ethyl(2-hydroxyethyl)amino]ethyl]-1,3-dimethylpurine-2,6-dione |
| InChI | InChI=1S/C20H27N5O3/c1-4-24(12-13-26)10-11-25-16(14-15-8-6-5-7-9-15)21-18-17(25)19(27)23(3)20(28)22(18)2/h5-9,26H,4,10-14H2,1-3H3 |
| InChIKey | VVUYEFBRTFASAH-UHFFFAOYSA-N |
| SMILES | CCN(CCN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CC3=CC=CC=C3)CCO |
