3-benzoyl-2-ethyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl furan-2-carboxylate
Chemical Structure Depiction of
3-benzoyl-2-ethyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl furan-2-carboxylate
3-benzoyl-2-ethyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl furan-2-carboxylate
Compound characteristics
| Compound ID: | D239-0004 |
| Compound Name: | 3-benzoyl-2-ethyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl furan-2-carboxylate |
| Molecular Weight: | 423.44 |
| Molecular Formula: | C22 H17 N O6 S |
| Smiles: | CCN1C(=C(c2ccccc2S1(=O)=O)OC(c1ccco1)=O)C(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5407 |
| logD: | 3.5407 |
| logSw: | -3.9136 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.409 |
| InChI Key: | JGQMWOWDYUWHOL-UHFFFAOYSA-N |