2-(4-chlorophenoxy)-3-[(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
2-(4-chlorophenoxy)-3-[(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
2-(4-chlorophenoxy)-3-[(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | Y070-2016 |
| Compound Name: | 2-(4-chlorophenoxy)-3-[(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 443.93 |
| Molecular Formula: | C20 H14 Cl N3 O3 S2 |
| Smiles: | CCN1C(/C(=C/C2=C(N=C3C=CC=CN3C2=O)Oc2ccc(cc2)[Cl])SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.882 |
| logD: | 3.882 |
| logSw: | -4.4765 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 48.942 |
| InChI Key: | KLRLOFSMFMNKOI-UHFFFAOYSA-N |