2-[(3-methoxyphenyl)methylidene]-4-methyl-6-[4-(pyridin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
2-[(3-methoxyphenyl)methylidene]-4-methyl-6-[4-(pyridin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzothiazin-3(4H)-one
2-[(3-methoxyphenyl)methylidene]-4-methyl-6-[4-(pyridin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | C310-2759 |
| Compound Name: | 2-[(3-methoxyphenyl)methylidene]-4-methyl-6-[4-(pyridin-2-yl)piperazine-1-carbonyl]-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 486.59 |
| Molecular Formula: | C27 H26 N4 O3 S |
| Smiles: | CN1C(/C(=C/c2cccc(c2)OC)Sc2ccc(cc12)C(N1CCN(CC1)c1ccccn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9497 |
| logD: | 3.9409 |
| logSw: | -4.1654 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.07 |
| InChI Key: | IHFRSXPWAGMQEZ-UHFFFAOYSA-N |