Theophylline, 7-(4-(4-(p-chlorophenyl)-1-piperazinyl)butyl)-, dihydrochloride
7-[4-[4-(4-chlorophenyl)piperazin-1-yl]butyl]-1,3-dimethylpurine-2,6-dione;dihydrochloride
Also Known As: Theophylline, 7-(4-(4-(p-chlorophenyl)-1-piperazinyl)butyl)-, dihydrochloride|7-(4-(4-(p-Chlorophenyl)-1-piperazinyl)butyl)theophylline dihydrochloride|1H-Purine-2,6-dione, 3,7-dihydro-7-(4-(4-(4-chlorophenyl)-1-piperazinyl)butyl)-1,3-dimethyl-,|7-(4-(4-(p-Chlorophenyl)piperazinyl-(1))-n-butyl)-theophyllin dihydrochlorid [German]|7-(4-(4-(p-Chlorophenyl)piperazinyl-(1))-n-butyl)-theophyllin dihydrochlorid|1h-purine-2,6-dione,3,7-dihydro-7-(4-(4-1,3-dimethyl-,|7-[4-[4-(4-chlorophenyl)piperazin-1-yl]butyl]-1,3-dimethylpurine-2,6-dione dihydrochloride|7-{4-[4-(4-Chlorophenyl)piperazin-1-yl]butyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione--hydrogen chloride (1/2)
| Molecular Formula | C21H29Cl3N6O2 |
|---|---|
| Molecular Weight | 502.14175 g/mol |
| LogP | 2.5331 |
| Topological Polar Surface Area | 68.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 502.14175 |
| Monoisotopic Mass | 502.14175 |
| Heavy Atoms | 32 |
| Complexity | 1147.2819 |
Chemical Identifiers
| CAS Number | 87798-85-4 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCCN3CCN(CC3)C4=CC=C(C=C4)Cl.Cl.Cl |
Product Overview
Theophylline, 7-(4-(4-(p-chlorophenyl)-1-piperazinyl)butyl)-, dihydrochloride (CAS 87798-85-4), with molecular formula C21H29Cl3N6O2 and molecular weight 502.14175 g/mol. IUPAC: 7-[4-[4-(4-chlorophenyl)piperazin-1-yl]butyl]-1,3-dimethylpurine-2,6-dione;dihydrochloride.
Theophylline, 7-(4-(4-(p-chlorophenyl)-1-piperazinyl)butyl)-, dihydrochloride is a custom synthesis product. We offer services from milligram to kilogram scale.
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