AC1MJW4Z
2-[2-(3,4-dimethylphenyl)-2-oxoethyl]sulfanyl-4-(4-methoxyphenyl)-6-phenylpyridine-3-carbonitrile
Also Known As: Oprea1_203290|Oprea1_291642|BAS 00801692|2-((2-(3,4-Dimethylphenyl)-2-oxoethyl)thio)-4-(4-methoxyphenyl)-6-phenylnicotinonitrile|2-[2-(3,4-Dimethyl-phenyl)-2-oxo-ethylsulfanyl]-4-(4-methoxy-phenyl)-6-phenyl-nicotinonitrile|2-[2-(3,4-dimethylphenyl)-2-oxoethyl]sulfanyl-4-(4-methoxyphenyl)-6-phenylpyridine-3-carbonitrile
| Molecular Formula | C29H24N2O2S |
|---|---|
| Molecular Weight | 464.15585 g/mol |
| LogP | 6.88772 |
| Topological Polar Surface Area | 62.98 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 464.15585 |
| Monoisotopic Mass | 464.15585 |
| Heavy Atoms | 34 |
| Complexity | 1374.1487 |
Chemical Identifiers
| CAS Number | 332018-76-5 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)CSC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=CC=C(C=C4)OC)C#N)C |
Product Overview
AC1MJW4Z (CAS 332018-76-5), with molecular formula C29H24N2O2S and molecular weight 464.15585 g/mol. IUPAC: 2-[2-(3,4-dimethylphenyl)-2-oxoethyl]sulfanyl-4-(4-methoxyphenyl)-6-phenylpyridine-3-carbonitrile.
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