2-(4-chlorobenzene-1-sulfonyl)-3-[9-methyl-4-oxo-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile
Chemical Structure Depiction of
2-(4-chlorobenzene-1-sulfonyl)-3-[9-methyl-4-oxo-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile
2-(4-chlorobenzene-1-sulfonyl)-3-[9-methyl-4-oxo-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile
Compound characteristics
| Compound ID: | Y070-2120 |
| Compound Name: | 2-(4-chlorobenzene-1-sulfonyl)-3-[9-methyl-4-oxo-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile |
| Molecular Weight: | 468.96 |
| Molecular Formula: | C23 H21 Cl N4 O3 S |
| Smiles: | CC1=CC=CN2C1=NC(=C(\C=C(/C#N)S(c1ccc(cc1)[Cl])(=O)=O)C2=O)N1CCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 3.644 |
| logD: | 3.644 |
| logSw: | -4.0625 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 74.61 |
| InChI Key: | GWHMQEPWECWKOG-UHFFFAOYSA-N |