2-[(3,4-dimethoxyphenyl)methylidene]-3-oxo-N-(propan-2-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
2-[(3,4-dimethoxyphenyl)methylidene]-3-oxo-N-(propan-2-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
2-[(3,4-dimethoxyphenyl)methylidene]-3-oxo-N-(propan-2-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
Compound ID: | K788-8856 |
Compound Name: | 2-[(3,4-dimethoxyphenyl)methylidene]-3-oxo-N-(propan-2-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
Molecular Weight: | 398.48 |
Molecular Formula: | C21 H22 N2 O4 S |
Smiles: | CC(C)NC(c1ccc2c(c1)NC(/C(=C\c1ccc(c(c1)OC)OC)S2)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.3292 |
logD: | 3.3292 |
logSw: | -3.7368 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 63.764 |
InChI Key: | SPMCRRUKBJWXPV-UHFFFAOYSA-N |