2-butyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl benzoate
Chemical Structure Depiction of
2-butyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl benzoate
2-butyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl benzoate
Compound characteristics
| Compound ID: | D316-0323 |
| Compound Name: | 2-butyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl benzoate |
| Molecular Weight: | 357.43 |
| Molecular Formula: | C19 H19 N O4 S |
| Smiles: | CCCCN1C=C(c2ccccc2S1(=O)=O)OC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5645 |
| logD: | 3.5645 |
| logSw: | -3.8351 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.481 |
| InChI Key: | SPUUEKSLWIGSAD-UHFFFAOYSA-N |