2-(2,6-dimethylmorpholin-4-yl)-3-{(E)-[3-(3-methoxypropyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
2-(2,6-dimethylmorpholin-4-yl)-3-{(E)-[3-(3-methoxypropyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
2-(2,6-dimethylmorpholin-4-yl)-3-{(E)-[3-(3-methoxypropyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | 4618-0239 |
| Compound Name: | 2-(2,6-dimethylmorpholin-4-yl)-3-{(E)-[3-(3-methoxypropyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 488.63 |
| Molecular Formula: | C23 H28 N4 O4 S2 |
| Smiles: | CC1CN(CC(C)O1)C1=C(\C=C2/C(N(CCCOC)C(=S)S2)=O)C(N2C=CC=C(C)C2=N1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.1574 |
| logD: | 2.1574 |
| logSw: | -2.1407 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 59.781 |
| InChI Key: | OFYYIWLNOYWOBK-UHFFFAOYSA-N |