![2-[(4-Chlorobenzyl)thio]pyrimidin-4-ol structure](/static/products/910/91063-28-4.png)
2-[(4-Chlorobenzyl)thio]pyrimidin-4-ol
2-[(4-chlorophenyl)methylsulfanyl]-1H-pyrimidin-6-one
Also Known As: Maybridge4_002205|NCIStruc1_000517|NCIStruc2_000463|2-[(4-chlorobenzyl)thio]pyrimidin-4-ol|2-[(4-chlorobenzyl)sulfanyl]pyrimidin-4-ol|2-((4-chlorobenzyl)thio)-4-pyrimidinol|NCGC00013596-02|NCGC00013596-03|NCGC00096709-01|NCGC00096709-02|NCI60_004151|2-[(4-chlorophenyl)methylsulfanyl]-1H-pyrimidin-6-one|2-[(4-chlorophenyl)methylthio]pyrimidin-4-ol|2-((4-chlorobenzyl)thio)pyrimidin-4(3H)-one|2-[(4-chlorobenzyl)thio]-4(3H)-pyrimidinone|2-(4-chloro-benzylsulfanyl)-3H-pyrimidin-4-one|AB00115454-01|SR-01000471154-1|BRD-K20546584-001-01-5|2-{[(4-Chlorophenyl)methyl]sulfanyl}pyrimidin-4(3H)-one|2-{[(4-CHLOROPHENYL)METHYL]SULFANYL}PYRIMIDIN-4-OL
| Molecular Formula | C11H9ClN2OS |
|---|---|
| Molecular Weight | 252.0124 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 252.0124 |
| Monoisotopic Mass | 252.0124 |
| Heavy Atoms | 16 |
| Complexity | 322.0 |
Chemical Identifiers
| CAS Number | 91063-28-4 |
|---|---|
| SMILES | C1=CC(=CC=C1CSC2=NC=CC(=O)N2)Cl |
| InChIKey | RVTXPYQZDUOGRG-UHFFFAOYSA-N |
Product Overview
2-[(4-Chlorobenzyl)thio]pyrimidin-4-ol (CAS 91063-28-4), with molecular formula C11H9ClN2OS and molecular weight 252.0124 g/mol. IUPAC: 2-[(4-chlorophenyl)methylsulfanyl]-1H-pyrimidin-6-one.