methyl 4-[(4-chlorobenzoyl)oxy]-2-ethyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazine-3-carboxylate
Chemical Structure Depiction of
methyl 4-[(4-chlorobenzoyl)oxy]-2-ethyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazine-3-carboxylate
methyl 4-[(4-chlorobenzoyl)oxy]-2-ethyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazine-3-carboxylate
Compound characteristics
| Compound ID: | D316-0552 |
| Compound Name: | methyl 4-[(4-chlorobenzoyl)oxy]-2-ethyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazine-3-carboxylate |
| Molecular Weight: | 421.85 |
| Molecular Formula: | C19 H16 Cl N O6 S |
| Smiles: | CCN1C(=C(c2ccccc2S1(=O)=O)OC(c1ccc(cc1)[Cl])=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.6155 |
| logD: | 3.6155 |
| logSw: | -4.267 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 73.538 |
| InChI Key: | VMSIZVIVUNMFBH-UHFFFAOYSA-N |