3-[(3-heptyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-9-methyl-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
3-[(3-heptyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-9-methyl-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
3-[(3-heptyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-9-methyl-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | 5999-5877 |
| Compound Name: | 3-[(3-heptyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-9-methyl-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 484.68 |
| Molecular Formula: | C25 H32 N4 O2 S2 |
| Smiles: | CCCCCCCN1C(/C(=C\C2=C(N=C3C(C)=CC=CN3C2=O)N2CCCCC2)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 5.595 |
| logD: | 5.595 |
| logSw: | -5.123 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 44.506 |
| InChI Key: | DNWGQUJBAPIZDZ-UHFFFAOYSA-N |