4-ethoxy-N-(2-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)benzene-1-sulfonamide
Chemical Structure Depiction of
4-ethoxy-N-(2-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)benzene-1-sulfonamide
4-ethoxy-N-(2-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | F881-0422 |
| Compound Name: | 4-ethoxy-N-(2-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}phenyl)benzene-1-sulfonamide |
| Molecular Weight: | 467.56 |
| Molecular Formula: | C23 H21 N3 O4 S2 |
| Smiles: | CCOc1ccc(cc1)S(Nc1ccccc1SCC1=CC(N2C=CC=CC2=N1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4866 |
| logD: | 3.4834 |
| logSw: | -3.652 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.029 |
| InChI Key: | JSAPPRPNNHCIEB-UHFFFAOYSA-N |