3-benzoyl-2-benzyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl furan-2-carboxylate
Chemical Structure Depiction of
3-benzoyl-2-benzyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl furan-2-carboxylate
3-benzoyl-2-benzyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl furan-2-carboxylate
Compound characteristics
| Compound ID: | D239-0035 |
| Compound Name: | 3-benzoyl-2-benzyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl furan-2-carboxylate |
| Molecular Weight: | 485.51 |
| Molecular Formula: | C27 H19 N O6 S |
| Smiles: | C(c1ccccc1)N1C(=C(c2ccccc2S1(=O)=O)OC(c1ccco1)=O)C(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.751 |
| logD: | 4.751 |
| logSw: | -4.9305 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.413 |
| InChI Key: | LJCJLBFGULNJDJ-UHFFFAOYSA-N |