4-[2-oxo-2-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)ethyl]-6-(pyrrolidine-1-sulfonyl)-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
4-[2-oxo-2-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)ethyl]-6-(pyrrolidine-1-sulfonyl)-2H-1,4-benzothiazin-3(4H)-one
4-[2-oxo-2-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)ethyl]-6-(pyrrolidine-1-sulfonyl)-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | E589-2565 |
| Compound Name: | 4-[2-oxo-2-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)ethyl]-6-(pyrrolidine-1-sulfonyl)-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 497.63 |
| Molecular Formula: | C25 H27 N3 O4 S2 |
| Smiles: | C1CCN(C1)S(c1ccc2c(c1)N(CC(N1CCC(=CC1)c1ccccc1)=O)C(CS2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3631 |
| logD: | 3.3631 |
| logSw: | -3.8456 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 63.817 |
| InChI Key: | XWEYFNCVXFFQGV-UHFFFAOYSA-N |