3-Methyl-7-propan-2-yl-8-propylsulfanylpurine-2,6-dione
3-methyl-7-propan-2-yl-8-propylsulfanylpurine-2,6-dione
Also Known As: ChemDiv2_003529|Oprea1_130002|Oprea1_486116|IDI1_002244|3-methyl-7-propan-2-yl-8-propylsulfanylpurine-2,6-dione|AB00667636-01|7-isopropyl-3-methyl-8-(propylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione|AG-690/11025052|7-isopropyl-3-methyl-8-(propylthio)-1H-purine-2,6(3H,7H)-dione|F0373-0578|3-methyl-7-(propan-2-yl)-8-(propylsulfanyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione|7-isopropyl-3-methyl-8-(propylthio)-3,7-dihydro-1H-purine-2,6-dione|3-methyl-7-(propan-2-yl)-8-(propylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
| Molecular Formula | C12H18N4O2S |
|---|---|
| Molecular Weight | 282.11505 g/mol |
| LogP | 1.5063 |
| Topological Polar Surface Area | 72.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 282.11505 |
| Monoisotopic Mass | 282.11505 |
| Heavy Atoms | 19 |
| Complexity | 710.8133 |
Chemical Identifiers
| CAS Number | 331675-01-5 |
|---|---|
| SMILES | CCCSC1=NC2=C(N1C(C)C)C(=O)NC(=O)N2C |
Product Overview
3-Methyl-7-propan-2-yl-8-propylsulfanylpurine-2,6-dione (CAS 331675-01-5), with molecular formula C12H18N4O2S and molecular weight 282.11505 g/mol. IUPAC: 3-methyl-7-propan-2-yl-8-propylsulfanylpurine-2,6-dione.