2-butyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl (2,5-dioxopyrrolidin-1-yl)acetate
Chemical Structure Depiction of
2-butyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl (2,5-dioxopyrrolidin-1-yl)acetate
2-butyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl (2,5-dioxopyrrolidin-1-yl)acetate
Compound characteristics
| Compound ID: | D316-0337 |
| Compound Name: | 2-butyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl (2,5-dioxopyrrolidin-1-yl)acetate |
| Molecular Weight: | 392.43 |
| Molecular Formula: | C18 H20 N2 O6 S |
| Smiles: | CCCCN1C=C(c2ccccc2S1(=O)=O)OC(CN1C(CCC1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7454 |
| logD: | 0.7454 |
| logSw: | -2.4022 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 81.238 |
| InChI Key: | NMMZAIDEZUUQMB-UHFFFAOYSA-N |