ethyl [(4-butyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]acetate
Chemical Structure Depiction of
ethyl [(4-butyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]acetate
ethyl [(4-butyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | K261-2739 |
| Compound Name: | ethyl [(4-butyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]acetate |
| Molecular Weight: | 356.46 |
| Molecular Formula: | C15 H20 N2 O4 S2 |
| Smiles: | CCCCN1C(=NS(c2ccccc12)(=O)=O)SCC(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 3.0848 |
| logD: | 3.0848 |
| logSw: | -3.3977 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.394 |
| InChI Key: | JRPKKHWOHYYZMF-UHFFFAOYSA-N |