methyl (3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)acetate
Chemical Structure Depiction of
methyl (3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)acetate
methyl (3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)acetate
Compound characteristics
| Compound ID: | K783-5086 |
| Compound Name: | methyl (3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)acetate |
| Molecular Weight: | 235.26 |
| Molecular Formula: | C11 H9 N O3 S |
| Smiles: | COC(/C=C1/C(Nc2ccccc2S1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7414 |
| logD: | 1.7414 |
| logSw: | -2.1949 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.695 |
| InChI Key: | MGAINRJZMKQGDQ-UHFFFAOYSA-N |