AC1NRHL3
6-(azepan-1-yl)-1-butyl-5-[[3-[(2-chlorophenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-4-methyl-2-oxopyridine-3-carbonitrile
Also Known As: 6-(azepan-1-yl)-1-butyl-5-[[3-[(2-chlorophenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-4-methyl-2-oxopyridine-3-carbonitrile
CAS: 7065-22-7
| Molecular Formula | C28H31ClN4O2S2 |
|---|---|
| Molecular Weight | 554.1577 g/mol |
| LogP | 6.2637 |
| Topological Polar Surface Area | 69.34 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 554.1577 |
| Monoisotopic Mass | 554.1577 |
| Heavy Atoms | 37 |
| Complexity | 1336.9132 |
Chemical Identifiers
| CAS Number | 7065-22-7 |
|---|---|
| SMILES | CCCCN1C(=C(C(=C(C1=O)C#N)C)C=C2C(=O)N(C(=S)S2)CC3=CC=CC=C3Cl)N4CCCCCC4 |
Product Overview
AC1NRHL3 (CAS 7065-22-7), with molecular formula C28H31ClN4O2S2 and molecular weight 554.1577 g/mol. IUPAC: 6-(azepan-1-yl)-1-butyl-5-[[3-[(2-chlorophenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-4-methyl-2-oxopyridine-3-carbonitrile.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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