AC1NYQJL
ethyl 1-[3-[(Z)-(3-butan-2-yl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-9-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperidine-4-carboxylate
Also Known As: ethyl 1-(3-{(Z)-[3-(butan-2-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)piperidine-4-carboxylate|(Z)-ethyl 1-(3-((3-(sec-butyl)-4-oxo-2-thioxothiazolidin-5-ylidene)methyl)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)piperidine-4-carboxylate|ethyl 1-(9-methyl-3-{[3-(methylpropyl)-4-oxo-2-thioxo(1,3-thiazolidin-5-yliden e)]methyl}-4-oxo-5-hydropyridino[1,2-a]pyrimidin-2-yl)piperidine-4-carboxylate|ethyl 1-[3-[(Z)-(3-butan-2-yl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-9-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperidine-4-carboxylate
| Molecular Formula | C25H30N4O4S2 |
|---|---|
| Molecular Weight | 514.17084 g/mol |
| LogP | 3.78212 |
| Topological Polar Surface Area | 84.22 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 514.17084 |
| Monoisotopic Mass | 514.17084 |
| Heavy Atoms | 35 |
| Complexity | 1264.0806 |
Chemical Identifiers
| CAS Number | 615271-80-2 |
|---|---|
| SMILES | CCC(C)N1C(=O)/C(=C/C2=C(N=C3C(=CC=CN3C2=O)C)N4CCC(CC4)C(=O)OCC)/SC1=S |
Product Overview
AC1NYQJL (CAS 615271-80-2), with molecular formula C25H30N4O4S2 and molecular weight 514.17084 g/mol. IUPAC: ethyl 1-[3-[(Z)-(3-butan-2-yl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-9-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperidine-4-carboxylate.
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