8-(benzylsulfanyl)-7-hexadecyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
8-benzylsulfanyl-7-hexadecyl-3-methylpurine-2,6-dione
Also Known As: BAS 00512108|8-(benzylsulfanyl)-7-hexadecyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione|8-benzylsulfanyl-7-hexadecyl-3-methylpurine-2,6-dione|AG-690/11241403|8-Benzylsulfanyl-7-hexadecyl-3-methyl-3,7-dihydro-purine-2,6-dione|8-(benzylthio)-7-hexadecyl-3-methyl-1H-purine-2,6(3H,7H)-dione|7-hexadecyl-3-methyl-8-(phenylmethylthio)-1,3,7-trihydropurine-2,6-dione
| Molecular Formula | C29H44N4O2S |
|---|---|
| Molecular Weight | 512.3185 g/mol |
| LogP | 7.1969 |
| Topological Polar Surface Area | 72.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 18 |
| Exact Mass | 512.3185 |
| Monoisotopic Mass | 512.3185 |
| Heavy Atoms | 36 |
| Complexity | 1149.7759 |
Chemical Identifiers
| CAS Number | 370072-97-2 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCN1C2=C(N=C1SCC3=CC=CC=C3)N(C(=O)NC2=O)C |
Product Overview
8-(benzylsulfanyl)-7-hexadecyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione (CAS 370072-97-2), with molecular formula C29H44N4O2S and molecular weight 512.3185 g/mol. IUPAC: 8-benzylsulfanyl-7-hexadecyl-3-methylpurine-2,6-dione.
8-(benzylsulfanyl)-7-hexadecyl-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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