methyl 4-[(2-methoxybenzoyl)oxy]-1,1-dioxo-2-(propan-2-yl)-1,2-dihydro-1lambda~6~,2-benzothiazine-3-carboxylate
Chemical Structure Depiction of
methyl 4-[(2-methoxybenzoyl)oxy]-1,1-dioxo-2-(propan-2-yl)-1,2-dihydro-1lambda~6~,2-benzothiazine-3-carboxylate
methyl 4-[(2-methoxybenzoyl)oxy]-1,1-dioxo-2-(propan-2-yl)-1,2-dihydro-1lambda~6~,2-benzothiazine-3-carboxylate
Compound characteristics
| Compound ID: | D316-0580 |
| Compound Name: | methyl 4-[(2-methoxybenzoyl)oxy]-1,1-dioxo-2-(propan-2-yl)-1,2-dihydro-1lambda~6~,2-benzothiazine-3-carboxylate |
| Molecular Weight: | 431.46 |
| Molecular Formula: | C21 H21 N O7 S |
| Smiles: | CC(C)N1C(=C(c2ccccc2S1(=O)=O)OC(c1ccccc1OC)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.8071 |
| logD: | 3.8071 |
| logSw: | -4.1066 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 81.559 |
| InChI Key: | CPUZRBOJXOMWJO-UHFFFAOYSA-N |