AC1LXL40
4-(2,3-dimethoxyphenyl)-2-(2-oxo-2-phenothiazin-10-ylethyl)sulfanyl-6-phenylpyridine-3-carbonitrile
Also Known As: Oprea1_813966|AN-919/14712043|4-(2,3-dimethoxyphenyl)-2-(2-oxo-2-phenothiazin-10-ylethyl)sulfanyl-6-phenylpyridine-3-carbonitrile|4-(2,3-dimethoxyphenyl)-2-{[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]sulfanyl}-6-phenylnicotinonitrile|4-(2,3-dimethoxyphenyl)-2-{[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]sulfanyl}-6-phenylpyridine-3-carbonitrile
| Molecular Formula | C34H25N3O3S2 |
|---|---|
| Molecular Weight | 587.1337 g/mol |
| LogP | 8.22608 |
| Topological Polar Surface Area | 75.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 587.1337 |
| Monoisotopic Mass | 587.1337 |
| Heavy Atoms | 42 |
| Complexity | 1791.1057 |
Chemical Identifiers
| CAS Number | 354792-40-8 |
|---|---|
| SMILES | COC1=CC=CC(=C1OC)C2=CC(=NC(=C2C#N)SCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)C6=CC=CC=C6 |
Product Overview
AC1LXL40 (CAS 354792-40-8), with molecular formula C34H25N3O3S2 and molecular weight 587.1337 g/mol. IUPAC: 4-(2,3-dimethoxyphenyl)-2-(2-oxo-2-phenothiazin-10-ylethyl)sulfanyl-6-phenylpyridine-3-carbonitrile.
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