AC1LHXK6
2-[(2-methoxyphenyl)methylsulfanyl]-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile
Also Known As: KS-00003RYL|SS-0526|2-[(2-methoxybenzyl)sulfanyl]-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile|AM-807/14957096|2-[(2-methoxyphenyl)methylsulfanyl]-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile|2-((2-Methoxybenzyl)thio)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile|2-{[(2-methoxyphenyl)methyl]sulfanyl}-5H,6H,7H,8H,9H-cyclohepta[b]pyridine-3-carbonitrile
| Molecular Formula | C19H20N2OS |
|---|---|
| Molecular Weight | 324.12964 g/mol |
| LogP | 4.52308 |
| Topological Polar Surface Area | 45.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 324.12964 |
| Monoisotopic Mass | 324.12964 |
| Heavy Atoms | 23 |
| Complexity | 736.6348 |
Chemical Identifiers
| CAS Number | 445384-18-9 |
|---|---|
| SMILES | COC1=CC=CC=C1CSC2=C(C=C3CCCCCC3=N2)C#N |
Product Overview
AC1LHXK6 (CAS 445384-18-9), with molecular formula C19H20N2OS and molecular weight 324.12964 g/mol. IUPAC: 2-[(2-methoxyphenyl)methylsulfanyl]-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile.
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