RefChem:1056246
(E)-1-(1,3-benzodioxol-5-yl)-4-methyl-5-(4-methylpiperazin-1-yl)pent-1-en-3-one
Also Known As: 5-23-02-00546 (Beilstein Handbook Reference)|1-Penten-3-one, 1-(1,3-benzodioxol-5-yl)-4-methyl-5-(4-methyl-1-piperazinyl)-|1-Penten-3-one, 4-methyl-1-(3,4-methylenedioxyphenyl)-5-(4-methyl-1-piperazinyl)-|4-Methyl-1-(3,4-methylenedioxyphenyl)-5-(4-methyl-1-piperazinyl)-1-penten-3-one|(E)-1-(1,3-benzodioxol-5-yl)-4-methyl-5-(4-methylpiperazin-1-yl)pent-1-en-3-one|1-(1,3-Benzodioxol-5-yl)-4-methyl-5-(4-methyl-1-piperazinyl)-1-penten-3-one|1-(2H-1,3-benzodioxol-5-yl)-4-methyl-5-(4-methylpiperazin-1-yl)pent-1-en-3-one
| Molecular Formula | C18H24N2O3 |
|---|---|
| Molecular Weight | 316.17868 g/mol |
| LogP | 1.8811 |
| Topological Polar Surface Area | 42.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 316.17868 |
| Monoisotopic Mass | 316.17868 |
| Heavy Atoms | 23 |
| Complexity | 591.92957 |
Chemical Identifiers
| CAS Number | 66596-45-0 |
|---|---|
| SMILES | CC(CN1CCN(CC1)C)C(=O)/C=C/C2=CC3=C(C=C2)OCO3 |
Product Overview
RefChem:1056246 (CAS 66596-45-0), with molecular formula C18H24N2O3 and molecular weight 316.17868 g/mol. IUPAC: (E)-1-(1,3-benzodioxol-5-yl)-4-methyl-5-(4-methylpiperazin-1-yl)pent-1-en-3-one.
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