7-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione
Chemical Structure Depiction of
7-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione
7-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione
Compound characteristics
| Compound ID: | E782-0643 |
| Compound Name: | 7-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione |
| Molecular Weight: | 408.46 |
| Molecular Formula: | C15 H16 N6 O4 S2 |
| Smiles: | C1CN(CCN1c1ncccn1)S(c1ccc2c(c1)S(NC=N2)(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3009 |
| logD: | 0.7916 |
| logSw: | -2.6271 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 105.425 |
| InChI Key: | MSOQXVMKFLIYAN-UHFFFAOYSA-N |