2-{2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}-N-cyclohexylacetamide
Chemical Structure Depiction of
2-{2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}-N-cyclohexylacetamide
2-{2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}-N-cyclohexylacetamide
Compound characteristics
Compound ID: | K788-5833 |
Compound Name: | 2-{2-[(3-bromo-4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}-N-cyclohexylacetamide |
Molecular Weight: | 501.44 |
Molecular Formula: | C24 H25 Br N2 O3 S |
Smiles: | COc1ccc(\C=C2/C(N(CC(NC3CCCCC3)=O)c3ccccc3S2)=O)cc1[Br] |
Stereo: | ACHIRAL |
logP: | 5.2047 |
logD: | 5.2047 |
logSw: | -4.888 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 46.897 |
InChI Key: | OSBRMUYZDBRQHS-UHFFFAOYSA-N |