Theobromine, 1-(3-(4-(o-chlorophenyl)-1-piperazinyl)propyl)-, dihydrochloride
1-[3-[4-(2-chlorophenyl)piperazin-1-yl]propyl]-3,7-dimethylpurine-2,6-dione;dihydrochloride
Also Known As: 1-(3-(4- theobrominedihydrochloride|Theobromine, 1-(3-(4-(o-chlorophenyl)-1-piperazinyl)propyl)-, dihydrochloride|1-(3-(4-(o-Chlorophenyl)-1-piperazinyl)propyl)theobromine dihydrochloride|1-(3-(4-(o-Chlorophenyl)piperazinyl-(1))-n-propyl)-theobromin dihydrochlorid [German]|1-(3-(4-(o-Chlorophenyl)piperazinyl-(1))-n-propyl)-theobromin dihydrochlorid|1H-Purine-2,6-dione, 1-(3-(4-(2-chlorophenyl)-1-piperazinyl)propyl)-3,7-dihydro-3,7-dimethyl-,|1-[3-[4-(2-chlorophenyl)piperazin-1-yl]propyl]-3,7-dimethylpurine-2,6-dione;dihydrochloride|1-[3-[4-(2-chlorophenyl)piperazin-1-yl]propyl]-3,7-dimethylpurine-2,6-dione dihydrochloride|1-{3-[4-(2-Chlorophenyl)piperazin-1-yl]propyl}-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione--hydrogen chloride (1/2)
| Molecular Formula | C20H27Cl3N6O2 |
|---|---|
| Molecular Weight | 488.1261 g/mol |
| LogP | 2.143 |
| Topological Polar Surface Area | 68.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 488.1261 |
| Monoisotopic Mass | 488.1261 |
| Heavy Atoms | 31 |
| Complexity | 1148.0032 |
Chemical Identifiers
| CAS Number | 87798-89-8 |
|---|---|
| SMILES | CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCN3CCN(CC3)C4=CC=CC=C4Cl.Cl.Cl |
Product Overview
Theobromine, 1-(3-(4-(o-chlorophenyl)-1-piperazinyl)propyl)-, dihydrochloride (CAS 87798-89-8), with molecular formula C20H27Cl3N6O2 and molecular weight 488.1261 g/mol. IUPAC: 1-[3-[4-(2-chlorophenyl)piperazin-1-yl]propyl]-3,7-dimethylpurine-2,6-dione;dihydrochloride.
Theobromine, 1-(3-(4-(o-chlorophenyl)-1-piperazinyl)propyl)-, dihydrochloride is a custom synthesis product. We offer services from milligram to kilogram scale.
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