N-(2,2-dimethoxyethyl)-2-{2-[(4-ethylphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}acetamide
Chemical Structure Depiction of
N-(2,2-dimethoxyethyl)-2-{2-[(4-ethylphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}acetamide
N-(2,2-dimethoxyethyl)-2-{2-[(4-ethylphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}acetamide
Compound characteristics
Compound ID: | C312-1718 |
Compound Name: | N-(2,2-dimethoxyethyl)-2-{2-[(4-ethylphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}acetamide |
Molecular Weight: | 426.53 |
Molecular Formula: | C23 H26 N2 O4 S |
Smiles: | CCc1ccc(\C=C2/C(N(CC(NCC(OC)OC)=O)c3ccccc3S2)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 3.5127 |
logD: | 3.5127 |
logSw: | -3.7185 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 55.307 |
InChI Key: | WMKCHSZDKNRNRV-UHFFFAOYSA-N |