methyl 1,1-dioxo-4-[(phenylacetyl)oxy]-2-(propan-2-yl)-1,2-dihydro-1lambda~6~,2-benzothiazine-3-carboxylate
Chemical Structure Depiction of
methyl 1,1-dioxo-4-[(phenylacetyl)oxy]-2-(propan-2-yl)-1,2-dihydro-1lambda~6~,2-benzothiazine-3-carboxylate
methyl 1,1-dioxo-4-[(phenylacetyl)oxy]-2-(propan-2-yl)-1,2-dihydro-1lambda~6~,2-benzothiazine-3-carboxylate
Compound characteristics
| Compound ID: | D316-0576 |
| Compound Name: | methyl 1,1-dioxo-4-[(phenylacetyl)oxy]-2-(propan-2-yl)-1,2-dihydro-1lambda~6~,2-benzothiazine-3-carboxylate |
| Molecular Weight: | 415.46 |
| Molecular Formula: | C21 H21 N O6 S |
| Smiles: | CC(C)N1C(=C(c2ccccc2S1(=O)=O)OC(Cc1ccccc1)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.7956 |
| logD: | 3.7956 |
| logSw: | -4.1167 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 73.334 |
| InChI Key: | BUAGYUYZEDQHDK-UHFFFAOYSA-N |