AC1LQWPT
8-[(4-benzylpiperazin-1-yl)methyl]-7-[(2-chloro-6-fluorophenyl)methyl]-1,3-dimethylpurine-2,6-dione
Also Known As: 8-[(4-benzylpiperazin-1-yl)methyl]-7-[(2-chloro-6-fluorophenyl)methyl]-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione|8-[(4-benzylpiperazin-1-yl)methyl]-7-(2-chloro-6-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione|8-[(4-benzylpiperazin-1-yl)methyl]-7-[(2-chloro-6-fluorophenyl)methyl]-1,3-dimethylpurine-2,6-dione|7-[(2-chloro-6-fluorophenyl)methyl]-1,3-dimethyl-8-{[4-benzylpiperazinyl]methy l}-1,3,7-trihydropurine-2,6-dione|8-((4-benzylpiperazin-1-yl)methyl)-7-(2-chloro-6-fluorobenzyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione|8-[(4-benzyl-1-piperazinyl)methyl]-7-(2-chloro-6-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
| Molecular Formula | C26H28ClFN6O2 |
|---|---|
| Molecular Weight | 510.19464 g/mol |
| LogP | 2.5923 |
| Topological Polar Surface Area | 68.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 510.19464 |
| Monoisotopic Mass | 510.19464 |
| Heavy Atoms | 36 |
| Complexity | 1499.4573 |
Chemical Identifiers
| CAS Number | 577982-27-5 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CN3CCN(CC3)CC4=CC=CC=C4)CC5=C(C=CC=C5Cl)F |
Product Overview
AC1LQWPT (CAS 577982-27-5), with molecular formula C26H28ClFN6O2 and molecular weight 510.19464 g/mol. IUPAC: 8-[(4-benzylpiperazin-1-yl)methyl]-7-[(2-chloro-6-fluorophenyl)methyl]-1,3-dimethylpurine-2,6-dione.