Dihydrochloride
7-[2-hydroxy-3-[4-(3-phenylsulfanylpropyl)piperazin-1-yl]propyl]-1,3-dimethylpurine-2,6-dione;hydrochloride
Also Known As: Dihydrochloride|AC1L1GZI|AC1Q3ESK|TAZIFYLLINE HYDROCHLORIDE|Tazifylline hydrochloride [USAN]|QAGJABVPPQBKQB-UHFFFAOYSA-N|LN 2974|(+-)-7-(2-Hydroxy-3-(4-(3-(phenylthio)propyl)-1-piperazinyl)propyl)theophylline dihydrochloride|1-[3-(1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dion-7-yl)-2-hydroxypropyl]-4-(3-phenylthio-propyl)piperazine hydrochloride|1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-7-(2-hydroxy-3-(4-(3-(phenylthio)propyl)-1-piperazinyl)propyl)-, dihydrochloride|1H-Purine-2,6-dione, 3,7-dihydro-7-(2-hydroxy-3-(4-(3-(phenylthio)propyl)-1-piperazinyl)propyl)-1,3-dimethyl-, dihydrochloride, (+-)-|7-(2-hydroxy-3-{4-[3-(phenylsulfanyl)propyl]piperazin-1-yl}propyl)-1,3-dimethyl-3,7-dihydro-1h-purine-2,6-dione hydrochloride(1:1)|7-(2-Hydroxy-3-{4-[3-(phenylsulfanyl)propyl]piperazin-1-yl}propyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione--hydrogen chloride (1/1)|7-[2-hydroxy-3-[4-(3-phenylsulfanylpropyl)piperazin-1-yl]propyl]-1,3-dimethylpurine-2,6-dione hydrochloride
| Molecular Formula | C23H33ClN6O3S |
|---|---|
| Molecular Weight | 508.20233 g/mol |
| LogP | 1.02 |
| Topological Polar Surface Area | 88.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 508.20233 |
| Heavy Atoms | 34 |
| Complexity | 1187.1 |
Chemical Identifiers
| CAS Number | 79712-53-1 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(CN3CCN(CC3)CCCSC4=CC=CC=C4)O.Cl |
Product Overview
Dihydrochloride (CAS 79712-53-1), with molecular formula C23H33ClN6O3S and molecular weight 508.20233 g/mol. IUPAC: 7-[2-hydroxy-3-[4-(3-phenylsulfanylpropyl)piperazin-1-yl]propyl]-1,3-dimethylpurine-2,6-dione;hydrochloride.
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