2-[2-(3-fluoro-4-methylphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]-N-(3-methylbutyl)acetamide
Chemical Structure Depiction of
2-[2-(3-fluoro-4-methylphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]-N-(3-methylbutyl)acetamide
2-[2-(3-fluoro-4-methylphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]-N-(3-methylbutyl)acetamide
Compound characteristics
| Compound ID: | K261-2433 |
| Compound Name: | 2-[2-(3-fluoro-4-methylphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]-N-(3-methylbutyl)acetamide |
| Molecular Weight: | 433.5 |
| Molecular Formula: | C21 H24 F N3 O4 S |
| Smiles: | CC(C)CCNC(CN1C(N(c2ccc(C)c(c2)F)S(c2ccccc12)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7455 |
| logD: | 3.7455 |
| logSw: | -3.8966 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.327 |
| InChI Key: | QKGVSDOBMSIKLO-UHFFFAOYSA-N |