2-[2-(3,5-dimethylphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]-N-[(4-methylphenyl)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-[(4-methylphenyl)methyl]acetamide
2-[2-(3,5-dimethylphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]-N-[(4-methylphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | K261-1030 |
| Compound Name: | 2-[2-(3,5-dimethylphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]-N-[(4-methylphenyl)methyl]acetamide |
| Molecular Weight: | 463.55 |
| Molecular Formula: | C25 H25 N3 O4 S |
| Smiles: | Cc1ccc(CNC(CN2C(N(c3cc(C)cc(C)c3)S(c3ccccc23)(=O)=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.6335 |
| logD: | 4.6335 |
| logSw: | -4.3103 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.214 |
| InChI Key: | VYGFOUXNIZVKIF-UHFFFAOYSA-N |