AC1MKL79
7-[(4-fluorophenyl)methyl]-3-methyl-8-(4-methylpiperazin-1-yl)purine-2,6-dione
Also Known As: BAS 09857772|7-(4-fluorobenzyl)-3-methyl-8-(4-methylpiperazin-1-yl)-1H-purine-2,6(3H,7H)-dione|F1687-0191|7-[(4-fluorophenyl)methyl]-3-methyl-8-(4-methylpiperazin-1-yl)purine-2,6-dione|7-(4-fluorobenzyl)-6-hydroxy-3-methyl-8-(4-methylpiperazin-1-yl)-3,7-dihydro-2H-purin-2-one|7-[(4-fluorophenyl)methyl]-3-methyl-8-(4-methylpiperazinyl)-1,3,7-trihydropuri ne-2,6-dione
| Molecular Formula | C18H21FN6O2 |
|---|---|
| Molecular Weight | 372.171 g/mol |
| LogP | 0.3625 |
| Topological Polar Surface Area | 79.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 372.171 |
| Monoisotopic Mass | 372.171 |
| Heavy Atoms | 27 |
| Complexity | 1089.9678 |
Chemical Identifiers
| CAS Number | 850751-80-3 |
|---|---|
| SMILES | CN1CCN(CC1)C2=NC3=C(N2CC4=CC=C(C=C4)F)C(=O)NC(=O)N3C |
Product Overview
AC1MKL79 (CAS 850751-80-3), with molecular formula C18H21FN6O2 and molecular weight 372.171 g/mol. IUPAC: 7-[(4-fluorophenyl)methyl]-3-methyl-8-(4-methylpiperazin-1-yl)purine-2,6-dione.
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