methyl (2-oxo-2H-1,4-benzothiazin-3(4H)-ylidene)acetate
Chemical Structure Depiction of
methyl (2-oxo-2H-1,4-benzothiazin-3(4H)-ylidene)acetate
methyl (2-oxo-2H-1,4-benzothiazin-3(4H)-ylidene)acetate
Compound characteristics
| Compound ID: | 3456-2434 |
| Compound Name: | methyl (2-oxo-2H-1,4-benzothiazin-3(4H)-ylidene)acetate |
| Molecular Weight: | 235.26 |
| Molecular Formula: | C11 H9 N O3 S |
| Smiles: | COC(/C=C1/C(=O)Sc2ccccc2N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2003 |
| logD: | 2.1986 |
| logSw: | -2.7419 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.07 |
| InChI Key: | VGBWLEISWLDUGT-UHFFFAOYSA-N |