1-{3-[2-(benzenesulfonyl)-2-cyanoethenyl]-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}piperidine-4-carboxamide
Chemical Structure Depiction of
1-{3-[2-(benzenesulfonyl)-2-cyanoethenyl]-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}piperidine-4-carboxamide
1-{3-[2-(benzenesulfonyl)-2-cyanoethenyl]-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | Y070-2077 |
| Compound Name: | 1-{3-[2-(benzenesulfonyl)-2-cyanoethenyl]-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}piperidine-4-carboxamide |
| Molecular Weight: | 463.51 |
| Molecular Formula: | C23 H21 N5 O4 S |
| Smiles: | C1CN(CCC1C(N)=O)C1=C(\C=C(/C#N)S(c2ccccc2)(=O)=O)C(N2C=CC=CC2=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9735 |
| logD: | 0.9735 |
| logSw: | -2.1859 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 109.648 |
| InChI Key: | SWEGBEXZQDSAIZ-UHFFFAOYSA-N |