7-[2-(azepan-1-yl)-2-oxoethanesulfonyl]-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione
Chemical Structure Depiction of
7-[2-(azepan-1-yl)-2-oxoethanesulfonyl]-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione
7-[2-(azepan-1-yl)-2-oxoethanesulfonyl]-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione
Compound characteristics
| Compound ID: | G428-0520 |
| Compound Name: | 7-[2-(azepan-1-yl)-2-oxoethanesulfonyl]-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione |
| Molecular Weight: | 385.46 |
| Molecular Formula: | C15 H19 N3 O5 S2 |
| Smiles: | C1CCCN(CC1)C(CS(c1ccc2c(c1)S(N=CN2)(=O)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9326 |
| logD: | 0.8986 |
| logSw: | -2.4435 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.812 |
| InChI Key: | PZWOECGIQASKDZ-UHFFFAOYSA-N |