2-[(4-benzyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]-N-(3-bromophenyl)acetamide
Chemical Structure Depiction of
2-[(4-benzyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]-N-(3-bromophenyl)acetamide
2-[(4-benzyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]-N-(3-bromophenyl)acetamide
Compound characteristics
| Compound ID: | K261-2841 |
| Compound Name: | 2-[(4-benzyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]-N-(3-bromophenyl)acetamide |
| Molecular Weight: | 516.43 |
| Molecular Formula: | C22 H18 Br N3 O3 S2 |
| Smiles: | C(c1ccccc1)N1C(=NS(c2ccccc12)(=O)=O)SCC(Nc1cccc(c1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.0202 |
| logD: | 5.0201 |
| logSw: | -4.8214 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.863 |
| InChI Key: | ZOKCBEGNIQAAKO-UHFFFAOYSA-N |