2-[2-(3,5-dimethylphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]-N-[(3-methoxyphenyl)methyl]acetamide
Chemical Structure Depiction of
2-[2-(3,5-dimethylphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]-N-[(3-methoxyphenyl)methyl]acetamide
2-[2-(3,5-dimethylphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]-N-[(3-methoxyphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | K261-3026 |
| Compound Name: | 2-[2-(3,5-dimethylphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]-N-[(3-methoxyphenyl)methyl]acetamide |
| Molecular Weight: | 479.55 |
| Molecular Formula: | C25 H25 N3 O5 S |
| Smiles: | Cc1cc(C)cc(c1)N1C(N(CC(NCc2cccc(c2)OC)=O)c2ccccc2S1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3074 |
| logD: | 4.3074 |
| logSw: | -4.3361 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.758 |
| InChI Key: | BBWJTFGBVSVVOU-UHFFFAOYSA-N |