2-(2-ethoxyanilino)-2-oxoethyl 4-(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)-3,3-dimethylbutanoate
Chemical Structure Depiction of
2-(2-ethoxyanilino)-2-oxoethyl 4-(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)-3,3-dimethylbutanoate
2-(2-ethoxyanilino)-2-oxoethyl 4-(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)-3,3-dimethylbutanoate
Compound characteristics
| Compound ID: | K261-1409 |
| Compound Name: | 2-(2-ethoxyanilino)-2-oxoethyl 4-(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)-3,3-dimethylbutanoate |
| Molecular Weight: | 473.55 |
| Molecular Formula: | C23 H27 N3 O6 S |
| Smiles: | CCOc1ccccc1NC(COC(CC(C)(C)CC1NS(c2ccccc2N=1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.479 |
| logD: | 1.9047 |
| logSw: | -2.8639 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.82 |
| InChI Key: | XPURLVYSUCBGNK-UHFFFAOYSA-N |