AC1LLXME
8-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3-dimethyl-7-(2-methylprop-2-enyl)purine-2,6-dione
Also Known As: BAS 08333449|VU0324454-2|F1614-0270|8-(4-(4-methoxyphenyl)piperazin-1-yl)-1,3-dimethyl-7-(2-methylallyl)-1H-purine-2,6(3H,7H)-dione|8-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3-dimethyl-7-(2-methylprop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione|8-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3-dimethyl-7-(2-methylprop-2-enyl)purine-2,6-dione
| Molecular Formula | C22H28N6O3 |
|---|---|
| Molecular Weight | 424.2223 g/mol |
| LogP | 1.345 |
| Topological Polar Surface Area | 77.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 424.2223 |
| Monoisotopic Mass | 424.2223 |
| Heavy Atoms | 31 |
| Complexity | 1243.4625 |
Chemical Identifiers
| CAS Number | 797775-40-7 |
|---|---|
| SMILES | CC(=C)CN1C2=C(N=C1N3CCN(CC3)C4=CC=C(C=C4)OC)N(C(=O)N(C2=O)C)C |
Product Overview
AC1LLXME (CAS 797775-40-7), with molecular formula C22H28N6O3 and molecular weight 424.2223 g/mol. IUPAC: 8-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3-dimethyl-7-(2-methylprop-2-enyl)purine-2,6-dione.
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