2-[2-(4-acetylphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
Chemical Structure Depiction of
2-[2-(4-acetylphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
2-[2-(4-acetylphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
Compound characteristics
| Compound ID: | K261-1214 |
| Compound Name: | 2-[2-(4-acetylphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide |
| Molecular Weight: | 537.59 |
| Molecular Formula: | C27 H27 N3 O7 S |
| Smiles: | CC(c1ccc(cc1)N1C(N(CC(NCCc2ccc(c(c2)OC)OC)=O)c2ccccc2S1(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0722 |
| logD: | 2.0722 |
| logSw: | -2.893 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 100.143 |
| InChI Key: | ACJNOTZZWTUCAG-UHFFFAOYSA-N |