1-(4-bromophenyl)-2-(7H-purin-6-ylsulfanyl)ethanone
1-(4-bromophenyl)-2-(7H-purin-6-ylsulfanyl)ethanone
Also Known As: Oprea1_009749|Oprea1_420233|1-(4-bromophenyl)-2-(7H-purin-6-ylsulfanyl)ethanone|AG-205/12075185|AH-262/37240007|1-(4-bromophenyl)-2-(7H-purin-6-ylthio)ethanone|SR-01000221172-1|1-(4-bromophenyl)-2-(9H-purin-6-ylsulfanyl)ethanone|2-((9H-purin-6-yl)thio)-1-(4-bromophenyl)ethanone
CAS: 80985-23-5
| Molecular Formula | C13H9BrN4OS |
|---|---|
| Molecular Weight | 347.96805 g/mol |
| LogP | 3.0904 |
| Topological Polar Surface Area | 71.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 347.96805 |
| Monoisotopic Mass | 347.96805 |
| Heavy Atoms | 20 |
| Complexity | 756.412 |
Chemical Identifiers
| CAS Number | 80985-23-5 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)CSC2=NC=NC3=C2NC=N3)Br |
Product Overview
1-(4-bromophenyl)-2-(7H-purin-6-ylsulfanyl)ethanone (CAS 80985-23-5), with molecular formula C13H9BrN4OS and molecular weight 347.96805 g/mol. IUPAC: 1-(4-bromophenyl)-2-(7H-purin-6-ylsulfanyl)ethanone.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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1-(4-bromophenyl)-2-(7H-purin-6-ylsulfanyl)ethanone is a custom synthesis product. We offer services from milligram to kilogram scale.
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