3-benzoyl-2-butyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl furan-2-carboxylate
Chemical Structure Depiction of
3-benzoyl-2-butyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl furan-2-carboxylate
3-benzoyl-2-butyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl furan-2-carboxylate
Compound characteristics
| Compound ID: | D239-0026 |
| Compound Name: | 3-benzoyl-2-butyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl furan-2-carboxylate |
| Molecular Weight: | 451.5 |
| Molecular Formula: | C24 H21 N O6 S |
| Smiles: | CCCCN1C(=C(c2ccccc2S1(=O)=O)OC(c1ccco1)=O)C(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4169 |
| logD: | 4.4169 |
| logSw: | -4.2355 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.663 |
| InChI Key: | BEXRDFDQLKJUMW-UHFFFAOYSA-N |