2-{2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}-N-[(4-methylphenyl)methyl]acetamide
Chemical Structure Depiction of
2-{2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}-N-[(4-methylphenyl)methyl]acetamide
2-{2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}-N-[(4-methylphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | K788-5821 |
| Compound Name: | 2-{2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}-N-[(4-methylphenyl)methyl]acetamide |
| Molecular Weight: | 523.45 |
| Molecular Formula: | C26 H23 Br N2 O3 S |
| Smiles: | Cc1ccc(CNC(CN2C(/C(=C\c3ccc(c(c3)[Br])OC)Sc3ccccc23)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.4068 |
| logD: | 5.4068 |
| logSw: | -5.3191 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.172 |
| InChI Key: | XIOFBRUSNLCPCR-UHFFFAOYSA-N |