3-benzoyl-2-(2-ethoxy-2-oxoethyl)-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl 2,2-dimethylpropanoate
Chemical Structure Depiction of
3-benzoyl-2-(2-ethoxy-2-oxoethyl)-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl 2,2-dimethylpropanoate
3-benzoyl-2-(2-ethoxy-2-oxoethyl)-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl 2,2-dimethylpropanoate
Compound characteristics
| Compound ID: | D239-0143 |
| Compound Name: | 3-benzoyl-2-(2-ethoxy-2-oxoethyl)-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl 2,2-dimethylpropanoate |
| Molecular Weight: | 471.53 |
| Molecular Formula: | C24 H25 N O7 S |
| Smiles: | CCOC(CN1C(=C(c2ccccc2S1(=O)=O)OC(C(C)(C)C)=O)C(c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.219 |
| logD: | 4.219 |
| logSw: | -4.3256 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 86.536 |
| InChI Key: | RDEGUHNKJRUUNP-UHFFFAOYSA-N |