AC1NYKUI
(5Z)-5-[(9-methyl-4-oxo-2-thiomorpholin-4-ylpyrido[1,2-a]pyrimidin-3-yl)methylidene]-3-[(4-methylphenyl)methyl]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: 9-methyl-3-{(Z)-[3-(4-methylbenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(thiomorpholin-4-yl)-4H-pyrido[1,2-a]pyrimidin-4-one|(Z)-5-((9-methyl-4-oxo-2-thiomorpholino-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-3-(4-methylbenzyl)-2-thioxothiazolidin-4-one|(5Z)-5-[(9-methyl-4-oxo-2-thiomorpholin-4-ylpyrido[1,2-a]pyrimidin-3-yl)methylidene]-3-[(4-methylphenyl)methyl]-2-sulfanylidene-1,3-thiazolidin-4-one|5-[(9-methyl-4-oxo-2-(1,4-thiazaperhydroin-4-yl)(5-hydropyridino[1,2-a]pyrimid in-3-yl))methylene]-3-[(4-methylphenyl)methyl]-2-thioxo-1,3-thiazolidin-4-one
| Molecular Formula | C25H24N4O2S3 |
|---|---|
| Molecular Weight | 508.10614 g/mol |
| LogP | 4.26594 |
| Topological Polar Surface Area | 57.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 508.10614 |
| Monoisotopic Mass | 508.10614 |
| Heavy Atoms | 34 |
| Complexity | 1375.4115 |
Chemical Identifiers
| CAS Number | 489404-40-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN2C(=O)/C(=C/C3=C(N=C4C(=CC=CN4C3=O)C)N5CCSCC5)/SC2=S |
Product Overview
AC1NYKUI (CAS 489404-40-2), with molecular formula C25H24N4O2S3 and molecular weight 508.10614 g/mol. IUPAC: (5Z)-5-[(9-methyl-4-oxo-2-thiomorpholin-4-ylpyrido[1,2-a]pyrimidin-3-yl)methylidene]-3-[(4-methylphenyl)methyl]-2-sulfanylidene-1,3-thiazolidin-4-one.