N-benzyl-2-[2-(3,5-dimethylphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]acetamide
Chemical Structure Depiction of
N-benzyl-2-[2-(3,5-dimethylphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]acetamide
N-benzyl-2-[2-(3,5-dimethylphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]acetamide
Compound characteristics
| Compound ID: | K261-3022 |
| Compound Name: | N-benzyl-2-[2-(3,5-dimethylphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]acetamide |
| Molecular Weight: | 449.53 |
| Molecular Formula: | C24 H23 N3 O4 S |
| Smiles: | Cc1cc(C)cc(c1)N1C(N(CC(NCc2ccccc2)=O)c2ccccc2S1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2101 |
| logD: | 4.2101 |
| logSw: | -4.2325 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.214 |
| InChI Key: | YSZSOHJCYLVVFA-UHFFFAOYSA-N |