4-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-6-(pyrrolidine-1-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
4-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-6-(pyrrolidine-1-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one
4-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-6-(pyrrolidine-1-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | C534-0596 |
| Compound Name: | 4-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-6-(pyrrolidine-1-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 485.56 |
| Molecular Formula: | C23 H27 N5 O5 S |
| Smiles: | C1CCN(C1)S(c1ccc2c(c1)N(CC(N1CCN(CC1)c1ccccn1)=O)C(CO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4754 |
| logD: | 1.4666 |
| logSw: | -2.4604 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 84.309 |
| InChI Key: | WMQZTJHUSPIOTL-UHFFFAOYSA-N |