AC1MROB8
6-(4-tert-butylphenyl)-2-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-4-phenylpyridine-3-carbonitrile
Also Known As: 6-(4-tert-butylphenyl)-2-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-4-phenylpyridine-3-carbonitrile|2-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanyl-4-phenyl-6-(4-tert-butylphenyl)pyridine-3-carbonitrile|6-(4-tert-butylphenyl)-2-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-4-phenylpyridine-3-carbonitrile|6-[4-(tert-butyl)phenyl]-2-[2-(4-methoxyphenyl)-2-oxoethylthio]-4-phenylpyridi ne-3-carbonitrile|6-[4-(TERT-BUTYL)PHENYL]-2-{[2-(4-METHOXYPHENYL)-2-OXOETHYL]SULFANYL}-4-PHENYL-3-PYRIDYL CYANIDE
| Molecular Formula | C31H28N2O2S |
|---|---|
| Molecular Weight | 492.18716 g/mol |
| LogP | 7.56838 |
| Topological Polar Surface Area | 62.98 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 492.18716 |
| Monoisotopic Mass | 492.18716 |
| Heavy Atoms | 36 |
| Complexity | 1398.8934 |
Chemical Identifiers
| CAS Number | 362499-01-2 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCC(=O)C4=CC=C(C=C4)OC |
Product Overview
AC1MROB8 (CAS 362499-01-2), with molecular formula C31H28N2O2S and molecular weight 492.18716 g/mol. IUPAC: 6-(4-tert-butylphenyl)-2-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-4-phenylpyridine-3-carbonitrile.
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