2-{2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]acetamide
Chemical Structure Depiction of
2-{2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]acetamide
2-{2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]acetamide
Compound characteristics
| Compound ID: | K788-5850 |
| Compound Name: | 2-{2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]acetamide |
| Molecular Weight: | 581.48 |
| Molecular Formula: | C28 H25 Br N2 O5 S |
| Smiles: | CC(c1ccc2c(c1)OCCO2)NC(CN1C(/C(=C\c2ccc(c(c2)[Br])OC)Sc2ccccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4851 |
| logD: | 4.4851 |
| logSw: | -4.2397 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.158 |
| InChI Key: | PIYKOCFPKPBCSS-KRWDZBQOSA-N |