3-{[4-oxo-3-(1-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
3-{[4-oxo-3-(1-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
3-{[4-oxo-3-(1-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | 4428-0100 |
| Compound Name: | 3-{[4-oxo-3-(1-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 476.62 |
| Molecular Formula: | C25 H24 N4 O2 S2 |
| Smiles: | CC(c1ccccc1)N1C(/C(=C/C2=C(N=C3C=CC=CN3C2=O)N2CCCCC2)SC1=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2415 |
| logD: | 4.2415 |
| logSw: | -4.1382 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 44.577 |
| InChI Key: | INYVQNWPLNOJQV-KRWDZBQOSA-N |