methyl 4-[(2,2-dimethylpropanoyl)oxy]-2-ethyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazine-3-carboxylate
Chemical Structure Depiction of
methyl 4-[(2,2-dimethylpropanoyl)oxy]-2-ethyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazine-3-carboxylate
methyl 4-[(2,2-dimethylpropanoyl)oxy]-2-ethyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazine-3-carboxylate
Compound characteristics
| Compound ID: | D316-0562 |
| Compound Name: | methyl 4-[(2,2-dimethylpropanoyl)oxy]-2-ethyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazine-3-carboxylate |
| Molecular Weight: | 367.42 |
| Molecular Formula: | C17 H21 N O6 S |
| Smiles: | CCN1C(=C(c2ccccc2S1(=O)=O)OC(C(C)(C)C)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.0215 |
| logD: | 3.0215 |
| logSw: | -3.4824 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 73.809 |
| InChI Key: | KDIJKSVLNTVHPG-UHFFFAOYSA-N |