3-[(2-fluoroanilino)methylidene]-1-[(4-methylphenyl)methyl]-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione
Chemical Structure Depiction of
3-[(2-fluoroanilino)methylidene]-1-[(4-methylphenyl)methyl]-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione
3-[(2-fluoroanilino)methylidene]-1-[(4-methylphenyl)methyl]-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione
Compound characteristics
| Compound ID: | E745-0011 |
| Compound Name: | 3-[(2-fluoroanilino)methylidene]-1-[(4-methylphenyl)methyl]-2lambda~6~,1-benzothiazine-2,2,4(1H,3H)-trione |
| Molecular Weight: | 422.48 |
| Molecular Formula: | C23 H19 F N2 O3 S |
| Smiles: | Cc1ccc(CN2c3ccccc3C(/C(=C\Nc3ccccc3F)S2(=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.4555 |
| logD: | 4.4542 |
| logSw: | -4.4057 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.812 |
| InChI Key: | AGJZFAQTSXNSMX-UHFFFAOYSA-N |