2-(2,5-difluorophenyl)-4-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
Chemical Structure Depiction of
2-(2,5-difluorophenyl)-4-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
2-(2,5-difluorophenyl)-4-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
Compound characteristics
Compound ID: | K261-3088 |
Compound Name: | 2-(2,5-difluorophenyl)-4-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione |
Molecular Weight: | 449.48 |
Molecular Formula: | C21 H21 F2 N3 O4 S |
Smiles: | CC1CCN(CC1)C(CN1C(N(c2cc(ccc2F)F)S(c2ccccc12)(=O)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.0868 |
logD: | 3.0868 |
logSw: | -3.5886 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 62.834 |
InChI Key: | KKGXWZTVIPWHAN-UHFFFAOYSA-N |