2-(2,6-dimethylmorpholin-4-yl)-9-methyl-3-{(Z)-[4-oxo-3-(1-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
2-(2,6-dimethylmorpholin-4-yl)-9-methyl-3-{(Z)-[4-oxo-3-(1-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
2-(2,6-dimethylmorpholin-4-yl)-9-methyl-3-{(Z)-[4-oxo-3-(1-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | 4578-0056 |
| Compound Name: | 2-(2,6-dimethylmorpholin-4-yl)-9-methyl-3-{(Z)-[4-oxo-3-(1-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 520.67 |
| Molecular Formula: | C27 H28 N4 O3 S2 |
| Smiles: | CC(c1ccccc1)N1C(/C(=C/C2=C(N=C3C(C)=CC=CN3C2=O)N2CC(C)OC(C)C2)SC1=S)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.7829 |
| logD: | 3.7829 |
| logSw: | -3.97 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 50.53 |
| InChI Key: | VUBYFKBTSGCYHA-UHFFFAOYSA-N |