5-Benzyl-2-(methylsulfanyl)pyrimidine-4,6-diol
5-benzyl-4-hydroxy-2-methylsulfanyl-1H-pyrimidin-6-one
Also Known As: Oprea1_029670|Oprea1_358971|Oprea1_466239|NCGC00019658-01|NCGC00019658-02|BAS 00726099|5-benzyl-2-(methylthio)pyrimidine-4,6-diol|5-benzyl-2-(methylsulfanyl)pyrimidine-4,6-diol|AG-670/11900163|5-benzyl-4-hydroxy-2-methylsulfanyl-1H-pyrimidin-6-one|5-benzyl-6-hydroxy-2-(methylthio)-4(3H)-pyrimidinone|5-Benzyl-6-hydroxy-2-methylsulfanyl-3H-pyrimidin-4-one|5-benzyl-6-hydroxy-2-(methylsulfanyl)-4(1H)-pyrimidinone
| Molecular Formula | C12H12N2O2S |
|---|---|
| Molecular Weight | 248.06195 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 87.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 248.06195 |
| Monoisotopic Mass | 248.06195 |
| Heavy Atoms | 17 |
| Complexity | 371.0 |
Chemical Identifiers
| CAS Number | 331978-39-3 |
|---|---|
| SMILES | CSC1=NC(=C(C(=O)N1)CC2=CC=CC=C2)O |
| InChIKey | ZBSZIRBJORCNGH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Benzyl-2-(methylsulfanyl)pyrimidine-4,6-diol (CAS 331978-39-3), with molecular formula C12H12N2O2S and molecular weight 248.06195 g/mol. IUPAC: 5-benzyl-4-hydroxy-2-methylsulfanyl-1H-pyrimidin-6-one.
5-Benzyl-2-(methylsulfanyl)pyrimidine-4,6-diol is a custom synthesis product. We offer services from milligram to kilogram scale.
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