2-{2-[(4-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}-N-[(oxolan-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-{2-[(4-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}-N-[(oxolan-2-yl)methyl]acetamide
2-{2-[(4-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}-N-[(oxolan-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | C312-0797 |
| Compound Name: | 2-{2-[(4-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}-N-[(oxolan-2-yl)methyl]acetamide |
| Molecular Weight: | 428.94 |
| Molecular Formula: | C22 H21 Cl N2 O3 S |
| Smiles: | C1CC(CNC(CN2C(/C(=C\c3ccc(cc3)[Cl])Sc3ccccc23)=O)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6787 |
| logD: | 3.6787 |
| logSw: | -4.4794 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.195 |
| InChI Key: | NBVMKJBSMWAJMW-QGZVFWFLSA-N |