2-[(3-methoxyphenyl)methylidene]-4-methyl-6-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
2-[(3-methoxyphenyl)methylidene]-4-methyl-6-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzothiazin-3(4H)-one
2-[(3-methoxyphenyl)methylidene]-4-methyl-6-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | K788-7301 |
| Compound Name: | 2-[(3-methoxyphenyl)methylidene]-4-methyl-6-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 487.58 |
| Molecular Formula: | C26 H25 N5 O3 S |
| Smiles: | CN1C(/C(=C\c2cccc(c2)OC)Sc2ccc(cc12)C(N1CCN(CC1)c1ncccn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4468 |
| logD: | 3.4468 |
| logSw: | -3.8987 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.922 |
| InChI Key: | KXYLUBFGTMOPEZ-UHFFFAOYSA-N |