1-(4-chlorobenzyl)-3,7-dimethyl-8-(piperidin-1-yl)-1H-purine-2,6(3H,7H)-dione
1-[(4-chlorophenyl)methyl]-3,7-dimethyl-8-piperidin-1-ylpurine-2,6-dione
Also Known As: Oprea1_051883|Oprea1_724613|BAS 02224253|1-(4-chlorobenzyl)-3,7-dimethyl-8-(piperidin-1-yl)-1H-purine-2,6(3H,7H)-dione|VU0607691-1|SR-01000370390-1|1-[(4-chlorophenyl)methyl]-3,7-dimethyl-8-piperidin-1-ylpurine-2,6-dione|F3260-0151|1-[(4-chlorophenyl)methyl]-3,7-dimethyl-8-(piperidin-1-yl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione|1-(4-Chloro-benzyl)-3,7-dimethyl-8-piperidin-1-yl-3,7-dihydro-purine-2,6-dione|1-(4-chlorobenzyl)-3,7-dimethyl-8-(piperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
| Molecular Formula | C19H22ClN5O2 |
|---|---|
| Molecular Weight | 387.1462 g/mol |
| LogP | 2.1257 |
| Topological Polar Surface Area | 65.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 387.1462 |
| Monoisotopic Mass | 387.1462 |
| Heavy Atoms | 27 |
| Complexity | 1104.306 |
Chemical Identifiers
| CAS Number | 317841-03-5 |
|---|---|
| SMILES | CN1C2=C(N=C1N3CCCCC3)N(C(=O)N(C2=O)CC4=CC=C(C=C4)Cl)C |
Product Overview
1-(4-chlorobenzyl)-3,7-dimethyl-8-(piperidin-1-yl)-1H-purine-2,6(3H,7H)-dione (CAS 317841-03-5), with molecular formula C19H22ClN5O2 and molecular weight 387.1462 g/mol. IUPAC: 1-[(4-chlorophenyl)methyl]-3,7-dimethyl-8-piperidin-1-ylpurine-2,6-dione.