2-{2-[(4-methoxyphenyl)methyl]-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-[(4-methoxyphenyl)methyl]-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl}-N-(3-methylbutyl)acetamide
2-{2-[(4-methoxyphenyl)methyl]-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl}-N-(3-methylbutyl)acetamide
Compound characteristics
| Compound ID: | K261-2148 |
| Compound Name: | 2-{2-[(4-methoxyphenyl)methyl]-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl}-N-(3-methylbutyl)acetamide |
| Molecular Weight: | 445.54 |
| Molecular Formula: | C22 H27 N3 O5 S |
| Smiles: | CC(C)CCNC(CN1C(N(Cc2ccc(cc2)OC)S(c2ccccc12)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0074 |
| logD: | 3.0074 |
| logSw: | -3.5795 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.088 |
| InChI Key: | WUZDRHBHFGPJAK-UHFFFAOYSA-N |