4-methyl-2-[(2-methylphenyl)methylidene]-6-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
4-methyl-2-[(2-methylphenyl)methylidene]-6-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzothiazin-3(4H)-one
4-methyl-2-[(2-methylphenyl)methylidene]-6-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | K788-7297 |
| Compound Name: | 4-methyl-2-[(2-methylphenyl)methylidene]-6-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 471.58 |
| Molecular Formula: | C26 H25 N5 O2 S |
| Smiles: | Cc1ccccc1\C=C1/C(N(C)c2cc(ccc2S1)C(N1CCN(CC1)c1ncccn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9505 |
| logD: | 3.9505 |
| logSw: | -4.0443 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.378 |
| InChI Key: | HYIVNFHVGBOHBU-UHFFFAOYSA-N |