3-acetyl-2-butyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl furan-2-carboxylate
Chemical Structure Depiction of
3-acetyl-2-butyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl furan-2-carboxylate
3-acetyl-2-butyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl furan-2-carboxylate
Compound characteristics
| Compound ID: | D316-0071 |
| Compound Name: | 3-acetyl-2-butyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl furan-2-carboxylate |
| Molecular Weight: | 389.43 |
| Molecular Formula: | C19 H19 N O6 S |
| Smiles: | CCCCN1C(=C(c2ccccc2S1(=O)=O)OC(c1ccco1)=O)C(C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8407 |
| logD: | 2.8407 |
| logSw: | -3.5071 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 75.023 |
| InChI Key: | LQQJIUZGWPITKJ-UHFFFAOYSA-N |