2-{2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}-N-[2-(3,4-dimethoxyphenyl)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-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
2-{2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
Compound characteristics
| Compound ID: | K788-5822 |
| Compound Name: | 2-{2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide |
| Molecular Weight: | 583.5 |
| Molecular Formula: | C28 H27 Br N2 O5 S |
| Smiles: | COc1ccc(CCNC(CN2C(/C(=C\c3ccc(c(c3)[Br])OC)Sc3ccccc23)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.2752 |
| logD: | 4.2752 |
| logSw: | -4.2593 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.274 |
| InChI Key: | XZDNSCCUWAVKCY-UHFFFAOYSA-N |