3-[(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-(phenylsulfanyl)-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
3-[(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-(phenylsulfanyl)-4H-pyrido[1,2-a]pyrimidin-4-one
3-[(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-(phenylsulfanyl)-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | 4578-0803 |
| Compound Name: | 3-[(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-(phenylsulfanyl)-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 425.55 |
| Molecular Formula: | C20 H15 N3 O2 S3 |
| Smiles: | CCN1C(/C(=C/C2=C(N=C3C=CC=CN3C2=O)Sc2ccccc2)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.819 |
| logD: | 3.819 |
| logSw: | -4.0148 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 40.756 |
| InChI Key: | DNYFXWFJGXUMEQ-UHFFFAOYSA-N |