2-[(4-butyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]-N-[(2,3-dimethoxyphenyl)methyl]acetamide
Chemical Structure Depiction of
2-[(4-butyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]-N-[(2,3-dimethoxyphenyl)methyl]acetamide
2-[(4-butyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]-N-[(2,3-dimethoxyphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | K261-2742 |
| Compound Name: | 2-[(4-butyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]-N-[(2,3-dimethoxyphenyl)methyl]acetamide |
| Molecular Weight: | 477.6 |
| Molecular Formula: | C22 H27 N3 O5 S2 |
| Smiles: | CCCCN1C(=NS(c2ccccc12)(=O)=O)SCC(NCc1cccc(c1OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6959 |
| logD: | 3.6959 |
| logSw: | -3.8669 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.782 |
| InChI Key: | LFMDKNPINAHYIT-UHFFFAOYSA-N |