8-bromo-3-methyl-7-(3-(pyrimidin-2-ylthio)propyl)-1H-purine-2,6(3H,7H)-dione
8-bromo-3-methyl-7-(3-pyrimidin-2-ylsulfanylpropyl)purine-2,6-dione
Also Known As: NCGC00298623-01|AB01127932-02|8-bromo-3-methyl-7-(3-(pyrimidin-2-ylthio)propyl)-1H-purine-2,6(3H,7H)-dione|8-bromo-3-methyl-7-(3-pyrimidin-2-ylsulfanylpropyl)purine-2,6-dione|F2582-0094|8-bromo-3-methyl-7-[3-(pyrimidin-2-ylsulfanyl)propyl]-2,3,6,7-tetrahydro-1H-purine-2,6-dione|8-bromo-3-methyl-7-(3-pyrimidin-2-ylthiopropyl)-1,3,7-trihydropurine-2,6-dione|8-bromo-6-hydroxy-3-methyl-7-[3-(pyrimidin-2-ylsulfanyl)propyl]-3,7-dihydro-2H-purin-2-one
| Molecular Formula | C13H13BrN6O2S |
|---|---|
| Molecular Weight | 396.0004 g/mol |
| LogP | 1.1582 |
| Topological Polar Surface Area | 98.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 396.0004 |
| Monoisotopic Mass | 396.0004 |
| Heavy Atoms | 23 |
| Complexity | 948.7385 |
Chemical Identifiers
| CAS Number | 879470-75-4 |
|---|---|
| SMILES | CN1C2=C(C(=O)NC1=O)N(C(=N2)Br)CCCSC3=NC=CC=N3 |
Product Overview
8-bromo-3-methyl-7-(3-(pyrimidin-2-ylthio)propyl)-1H-purine-2,6(3H,7H)-dione (CAS 879470-75-4), with molecular formula C13H13BrN6O2S and molecular weight 396.0004 g/mol. IUPAC: 8-bromo-3-methyl-7-(3-pyrimidin-2-ylsulfanylpropyl)purine-2,6-dione.
8-bromo-3-methyl-7-(3-(pyrimidin-2-ylthio)propyl)-1H-purine-2,6(3H,7H)-dione is a custom synthesis product. We offer services from milligram to kilogram scale.
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