methyl 4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxylate
Chemical Structure Depiction of
methyl 4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxylate
methyl 4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxylate
Compound characteristics
| Compound ID: | K780-0705 |
| Compound Name: | methyl 4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxylate |
| Molecular Weight: | 251.3 |
| Molecular Formula: | C12 H13 N O3 S |
| Smiles: | CCN1C(CSc2ccc(cc12)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0929 |
| logD: | 2.0929 |
| logSw: | -2.619 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 36.789 |
| InChI Key: | YZEQTRBFWIQGJF-UHFFFAOYSA-N |