1-(9-methyl-4-oxo-3-{[4-oxo-3-(propan-2-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-2-yl)piperidine-4-carboxamide
Chemical Structure Depiction of
1-(9-methyl-4-oxo-3-{[4-oxo-3-(propan-2-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-2-yl)piperidine-4-carboxamide
1-(9-methyl-4-oxo-3-{[4-oxo-3-(propan-2-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-2-yl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | Y070-2258 |
| Compound Name: | 1-(9-methyl-4-oxo-3-{[4-oxo-3-(propan-2-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-2-yl)piperidine-4-carboxamide |
| Molecular Weight: | 471.6 |
| Molecular Formula: | C22 H25 N5 O3 S2 |
| Smiles: | CC(C)N1C(/C(=C/C2=C(N=C3C(C)=CC=CN3C2=O)N2CCC(CC2)C(N)=O)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 1.78 |
| logD: | 1.78 |
| logSw: | -2.1032 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.308 |
| InChI Key: | NWEYXKGSLAWRRV-UHFFFAOYSA-N |