2-[(3-chlorophenyl)methylidene]-4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxylic acid
Chemical Structure Depiction of
2-[(3-chlorophenyl)methylidene]-4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxylic acid
2-[(3-chlorophenyl)methylidene]-4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxylic acid
Compound characteristics
| Compound ID: | K783-6192 |
| Compound Name: | 2-[(3-chlorophenyl)methylidene]-4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxylic acid |
| Molecular Weight: | 345.8 |
| Molecular Formula: | C17 H12 Cl N O3 S |
| Smiles: | CN1C(/C(=C\c2cccc(c2)[Cl])Sc2ccc(cc12)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2246 |
| logD: | 1.5394 |
| logSw: | -4.3897 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.515 |
| InChI Key: | MFLAAGXBKNQNGO-UHFFFAOYSA-N |