7-(4-chlorobenzyl)-8-(dodecylsulfanyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
7-[(4-chlorophenyl)methyl]-8-dodecylsulfanyl-3-methylpurine-2,6-dione
Also Known As: BAS 00618995|7-(4-chlorobenzyl)-8-(dodecylsulfanyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione|AG-690/11571789|7-[(4-chlorophenyl)methyl]-8-dodecylsulfanyl-3-methylpurine-2,6-dione|7-(4-chlorobenzyl)-8-(dodecylthio)-3-methyl-1H-purine-2,6(3H,7H)-dione|7-(4-Chloro-benzyl)-8-dodecylsulfanyl-3-methyl-3,7-dihydro-purine-2,6-dione|7-(4-chlorobenzyl)-8-(dodecylthio)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
| Molecular Formula | C25H35ClN4O2S |
|---|---|
| Molecular Weight | 490.21692 g/mol |
| LogP | 6.138 |
| Topological Polar Surface Area | 72.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 14 |
| Exact Mass | 490.21692 |
| Monoisotopic Mass | 490.21692 |
| Heavy Atoms | 33 |
| Complexity | 1134.2449 |
Chemical Identifiers
| CAS Number | 331839-75-9 |
|---|---|
| SMILES | CCCCCCCCCCCCSC1=NC2=C(N1CC3=CC=C(C=C3)Cl)C(=O)NC(=O)N2C |
Product Overview
7-(4-chlorobenzyl)-8-(dodecylsulfanyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione (CAS 331839-75-9), with molecular formula C25H35ClN4O2S and molecular weight 490.21692 g/mol. IUPAC: 7-[(4-chlorophenyl)methyl]-8-dodecylsulfanyl-3-methylpurine-2,6-dione.
7-(4-chlorobenzyl)-8-(dodecylsulfanyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione is a custom synthesis product. We offer services from milligram to kilogram scale.
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