2-[2-(4-ethoxyphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]-N-(3-methylbutyl)acetamide
Chemical Structure Depiction of
2-[2-(4-ethoxyphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]-N-(3-methylbutyl)acetamide
2-[2-(4-ethoxyphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]-N-(3-methylbutyl)acetamide
Compound characteristics
| Compound ID: | K261-2849 |
| Compound Name: | 2-[2-(4-ethoxyphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]-N-(3-methylbutyl)acetamide |
| Molecular Weight: | 445.54 |
| Molecular Formula: | C22 H27 N3 O5 S |
| Smiles: | CCOc1ccc(cc1)N1C(N(CC(NCCC(C)C)=O)c2ccccc2S1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4749 |
| logD: | 3.4749 |
| logSw: | -3.7422 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.451 |
| InChI Key: | BXOCCJMWFDETCT-UHFFFAOYSA-N |