2-[(3,4-dimethoxyphenyl)methylidene]-4-methyl-6-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
2-[(3,4-dimethoxyphenyl)methylidene]-4-methyl-6-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzothiazin-3(4H)-one
2-[(3,4-dimethoxyphenyl)methylidene]-4-methyl-6-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | K788-7307 |
| Compound Name: | 2-[(3,4-dimethoxyphenyl)methylidene]-4-methyl-6-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 517.61 |
| Molecular Formula: | C27 H27 N5 O4 S |
| Smiles: | CN1C(/C(=C\c2ccc(c(c2)OC)OC)Sc2ccc(cc12)C(N1CCN(CC1)c1ncccn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0891 |
| logD: | 3.0891 |
| logSw: | -3.3945 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.639 |
| InChI Key: | WAJHHTCWCUZJBY-UHFFFAOYSA-N |