N-{2-[benzyl(methyl)amino]ethyl}-2-{2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}acetamide
Chemical Structure Depiction of
N-{2-[benzyl(methyl)amino]ethyl}-2-{2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}acetamide
N-{2-[benzyl(methyl)amino]ethyl}-2-{2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}acetamide
Compound characteristics
| Compound ID: | K788-5829 |
| Compound Name: | N-{2-[benzyl(methyl)amino]ethyl}-2-{2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}acetamide |
| Molecular Weight: | 566.52 |
| Molecular Formula: | C28 H28 Br N3 O3 S |
| Smiles: | CN(CCNC(CN1C(/C(=C\c2ccc(c(c2)[Br])OC)Sc2ccccc12)=O)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5292 |
| logD: | 4.0348 |
| logSw: | -4.255 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.107 |
| InChI Key: | SLGFCFLSIPBTGS-UHFFFAOYSA-N |