3-benzyl-5-[(4-oxo-2-{[(oxolan-2-yl)methyl]amino}-4H-pyrido[1,2-a]pyrimidin-3-yl)methylidene]-1,3-thiazolidine-2,4-dione
Chemical Structure Depiction of
3-benzyl-5-[(4-oxo-2-{[(oxolan-2-yl)methyl]amino}-4H-pyrido[1,2-a]pyrimidin-3-yl)methylidene]-1,3-thiazolidine-2,4-dione
3-benzyl-5-[(4-oxo-2-{[(oxolan-2-yl)methyl]amino}-4H-pyrido[1,2-a]pyrimidin-3-yl)methylidene]-1,3-thiazolidine-2,4-dione
Compound characteristics
| Compound ID: | 6000-0369 |
| Compound Name: | 3-benzyl-5-[(4-oxo-2-{[(oxolan-2-yl)methyl]amino}-4H-pyrido[1,2-a]pyrimidin-3-yl)methylidene]-1,3-thiazolidine-2,4-dione |
| Molecular Weight: | 462.53 |
| Molecular Formula: | C24 H22 N4 O4 S |
| Smiles: | C1CC(CNC2=C(/C=C3/C(N(Cc4ccccc4)C(=O)S3)=O)C(N3C=CC=CC3=N2)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6504 |
| logD: | 2.6502 |
| logSw: | -2.9229 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.993 |
| InChI Key: | KQMRJDGMMXCULA-QGZVFWFLSA-N |