N-[(4-methylphenyl)methyl]-2-{2-[3-(methylsulfanyl)phenyl]-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl}acetamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-2-{2-[3-(methylsulfanyl)phenyl]-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl}acetamide
N-[(4-methylphenyl)methyl]-2-{2-[3-(methylsulfanyl)phenyl]-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl}acetamide
Compound characteristics
| Compound ID: | K261-2921 |
| Compound Name: | N-[(4-methylphenyl)methyl]-2-{2-[3-(methylsulfanyl)phenyl]-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl}acetamide |
| Molecular Weight: | 481.59 |
| Molecular Formula: | C24 H23 N3 O4 S2 |
| Smiles: | Cc1ccc(CNC(CN2C(N(c3cccc(c3)SC)S(c3ccccc23)(=O)=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.0683 |
| logD: | 4.0683 |
| logSw: | -4.0491 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.214 |
| InChI Key: | STAYNVRJZBTXNK-UHFFFAOYSA-N |