AC1MJZ6O
4-(3,4-dimethoxyphenyl)-6-methylsulfanyl-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile
Also Known As: Oprea1_054671|Oprea1_112671|BAS 00866285|AE-848/11828120|SR-01000527950-1|A2182/0091705|4-(3,4-dimethoxyphenyl)-2-(methylsulfanyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile|4-(3,4-dimethoxyphenyl)-2-(methylsulfanyl)-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarbonitrile|4-(3,4-dimethoxyphenyl)-2-(methylthio)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile|4-(3,4-dimethoxyphenyl)-6-hydroxy-2-(methylsulfanyl)-4,5-dihydropyridine-3-carbonitrile|4-(3,4-dimethoxyphenyl)-6-methylsulfanyl-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile
| Molecular Formula | C15H16N2O3S |
|---|---|
| Molecular Weight | 304.08817 g/mol |
| LogP | 2.40548 |
| Topological Polar Surface Area | 71.35 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 304.08817 |
| Monoisotopic Mass | 304.08817 |
| Heavy Atoms | 21 |
| Complexity | 634.29614 |
Chemical Identifiers
| CAS Number | 309293-64-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2CC(=O)NC(=C2C#N)SC)OC |
Product Overview
AC1MJZ6O (CAS 309293-64-9), with molecular formula C15H16N2O3S and molecular weight 304.08817 g/mol. IUPAC: 4-(3,4-dimethoxyphenyl)-6-methylsulfanyl-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile.
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