AC1NRHGC
6-(azepan-1-yl)-1-butyl-4-methyl-5-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-oxopyridine-3-carbonitrile
Also Known As: 6-(Azepan-1-yl)-1-butyl-4-methyl-5-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-oxo-1,2-dihydropyridine-3-carbonitrile|6-(azepan-1-yl)-1-butyl-4-methyl-5-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-oxopyridine-3-carbonitrile
| Molecular Formula | C22H28N4O2S2 |
|---|---|
| Molecular Weight | 444.16537 g/mol |
| LogP | 4.0399 |
| Topological Polar Surface Area | 69.34 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 444.16537 |
| Monoisotopic Mass | 444.16537 |
| Heavy Atoms | 30 |
| Complexity | 982.3224 |
Chemical Identifiers
| CAS Number | 7065-19-2 |
|---|---|
| SMILES | CCCCN1C(=C(C(=C(C1=O)C#N)C)C=C2C(=O)N(C(=S)S2)C)N3CCCCCC3 |
Product Overview
AC1NRHGC (CAS 7065-19-2), with molecular formula C22H28N4O2S2 and molecular weight 444.16537 g/mol. IUPAC: 6-(azepan-1-yl)-1-butyl-4-methyl-5-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-oxopyridine-3-carbonitrile.
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