2-{[(oxolan-2-yl)methyl]amino}-3-{[4-oxo-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
2-{[(oxolan-2-yl)methyl]amino}-3-{[4-oxo-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
2-{[(oxolan-2-yl)methyl]amino}-3-{[4-oxo-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | 4428-0479 |
| Compound Name: | 2-{[(oxolan-2-yl)methyl]amino}-3-{[4-oxo-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 492.62 |
| Molecular Formula: | C25 H24 N4 O3 S2 |
| Smiles: | C1CC(CNC2=C(/C=C3/C(N(CCc4ccccc4)C(=S)S3)=O)C(N3C=CC=CC3=N2)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9002 |
| logD: | 2.9 |
| logSw: | -3.3959 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.818 |
| InChI Key: | GQICLGQYGMSVHW-GOSISDBHSA-N |