6-(morpholine-4-sulfonyl)-4-{2-oxo-2-[4-(pyrimidin-2-yl)piperazin-1-yl]ethyl}-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-(morpholine-4-sulfonyl)-4-{2-oxo-2-[4-(pyrimidin-2-yl)piperazin-1-yl]ethyl}-2H-1,4-benzoxazin-3(4H)-one
6-(morpholine-4-sulfonyl)-4-{2-oxo-2-[4-(pyrimidin-2-yl)piperazin-1-yl]ethyl}-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | C700-0734 |
| Compound Name: | 6-(morpholine-4-sulfonyl)-4-{2-oxo-2-[4-(pyrimidin-2-yl)piperazin-1-yl]ethyl}-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 502.55 |
| Molecular Formula: | C22 H26 N6 O6 S |
| Smiles: | C1CN(CCN1C(CN1C(COc2ccc(cc12)S(N1CCOCC1)(=O)=O)=O)=O)c1ncccn1 |
| Stereo: | ACHIRAL |
| logP: | 0.3135 |
| logD: | 0.3135 |
| logSw: | -2.2688 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 101.703 |
| InChI Key: | CSIBRSJWQIZCKR-UHFFFAOYSA-N |