2-Benzylthio-5-hexyl-6-hydroxy-3H-pyrimidin-4-one
2-benzylsulfanyl-5-hexyl-4-hydroxy-1H-pyrimidin-6-one
Also Known As: 2-Benzylthio-5-hexyl-6-hydroxy-3H-pyrimidin-4-one|2-(benzylsulfanyl)-5-hexyl-6-hydroxypyrimidin-4(3H)-one|SR-01000451273-1|2-(benzylthio)-5-hexyl-6-hydroxypyrimidin-4(3H)-one|2-benzylsulfanyl-5-hexyl-4-hydroxy-1H-pyrimidin-6-one|2-(Benzylsulfanyl)-5-hexyl-6-hydroxy-4(3H)-pyrimidinone #|5-hexyl-6-hydroxy-2-(phenylmethylthio)-3-hydropyrimidin-4-one
| Molecular Formula | C17H22N2O2S |
|---|---|
| Molecular Weight | 318.1402 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 87.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 318.1402 |
| Monoisotopic Mass | 318.1402 |
| Heavy Atoms | 22 |
| Complexity | 440.0 |
Chemical Identifiers
| CAS Number | 439131-89-2 |
|---|---|
| SMILES | CCCCCCC1=C(N=C(NC1=O)SCC2=CC=CC=C2)O |
| InChIKey | XKMHGSJQFQDQDH-UHFFFAOYSA-N |
Product Overview
2-Benzylthio-5-hexyl-6-hydroxy-3H-pyrimidin-4-one (CAS 439131-89-2), with molecular formula C17H22N2O2S and molecular weight 318.1402 g/mol. IUPAC: 2-benzylsulfanyl-5-hexyl-4-hydroxy-1H-pyrimidin-6-one.
2-Benzylthio-5-hexyl-6-hydroxy-3H-pyrimidin-4-one is a custom synthesis product. We offer services from milligram to kilogram scale.
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