AC1NRE20
5-[[3-(3-ethoxypropyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-4-methyl-6-(4-methylpiperazin-1-yl)-2-oxo-1-propylpyridine-3-carbonitrile
Also Known As: 5-[[3-(3-ethoxypropyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-4-methyl-6-(4-methylpiperazin-1-yl)-2-oxo-1-propylpyridine-3-carbonitrile|5-{[3-(3-Ethoxypropyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4-methyl-6-(4-methylpiperazin-1-yl)-2-oxo-1-propyl-1,2-dihydropyridine-3-carbonitrile
| Molecular Formula | C24H33N5O3S2 |
|---|---|
| Molecular Weight | 503.20248 g/mol |
| LogP | 2.818 |
| Topological Polar Surface Area | 81.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 503.20248 |
| Monoisotopic Mass | 503.20248 |
| Heavy Atoms | 34 |
| Complexity | 1067.8374 |
Chemical Identifiers
| CAS Number | 7064-19-9 |
|---|---|
| SMILES | CCCN1C(=C(C(=C(C1=O)C#N)C)C=C2C(=O)N(C(=S)S2)CCCOCC)N3CCN(CC3)C |
Product Overview
AC1NRE20 (CAS 7064-19-9), with molecular formula C24H33N5O3S2 and molecular weight 503.20248 g/mol. IUPAC: 5-[[3-(3-ethoxypropyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-4-methyl-6-(4-methylpiperazin-1-yl)-2-oxo-1-propylpyridine-3-carbonitrile.
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