8,8'-Propane-1,3-diylbis(1,3-dimethyl-3,7-dihydro-1h-purine-2,6-dione)
8-[3-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)propyl]-1,3-dimethyl-7H-purine-2,6-dione
Also Known As: 1,3-Bis(8-theophylline)propane|1,3-bis(theophyllin-8-yl)propane|Theophylline, 8,8'-trimethylenedi-|Theophylline (8CI),8'-trimethylenedi-|8,3-dimethylpurine-2,6(1H,3H)-dione|8,8'-propane-1,3-diylbis(1,3-dimethyl-3,7-dihydro-1h-purine-2,6-dione)|8-[3-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)propyl]-1,3-dimethyl-7H-purine-2,6-dione|1H-Purine-2, 8,8'-(1,3-propanediyl)bis(3,7-dihydro-1,3-dimethyl-|1H-Purine-2,6-dione, 8,8'-(1,3-propanediyl)bis(3,7-dihydro-1,3-dimethyl-|8,8'-(Propane-1,3-diyl)bis(1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione)
| Molecular Formula | C17H20N8O4 |
|---|---|
| Molecular Weight | 400.16074 g/mol |
| Topological Polar Surface Area | 139.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 400.16074 |
| Monoisotopic Mass | 400.16074 |
| Heavy Atoms | 29 |
| Complexity | 687.0 |
Chemical Identifiers
| CAS Number | 38975-83-6 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)NC(=N2)CCCC3=NC4=C(N3)C(=O)N(C(=O)N4C)C |
| InChIKey | UHILXWREAWPVNW-UHFFFAOYSA-N |
Product Overview
8,8'-Propane-1,3-diylbis(1,3-dimethyl-3,7-dihydro-1h-purine-2,6-dione) (CAS 38975-83-6), with molecular formula C17H20N8O4 and molecular weight 400.16074 g/mol. IUPAC: 8-[3-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)propyl]-1,3-dimethyl-7H-purine-2,6-dione.
8,8'-Propane-1,3-diylbis(1,3-dimethyl-3,7-dihydro-1h-purine-2,6-dione) is a custom synthesis product. We offer services from milligram to kilogram scale.
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