6-(4-benzylpiperazine-1-carbonyl)-2-[(3-methoxyphenyl)methylidene]-4-methyl-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
6-(4-benzylpiperazine-1-carbonyl)-2-[(3-methoxyphenyl)methylidene]-4-methyl-2H-1,4-benzothiazin-3(4H)-one
6-(4-benzylpiperazine-1-carbonyl)-2-[(3-methoxyphenyl)methylidene]-4-methyl-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | C310-2756 |
| Compound Name: | 6-(4-benzylpiperazine-1-carbonyl)-2-[(3-methoxyphenyl)methylidene]-4-methyl-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 499.63 |
| Molecular Formula: | C29 H29 N3 O3 S |
| Smiles: | CN1C(/C(=C/c2cccc(c2)OC)Sc2ccc(cc12)C(N1CCN(CC1)Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9632 |
| logD: | 3.9477 |
| logSw: | -4.1823 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 42.839 |
| InChI Key: | XDMBIYBMPJFGRW-UHFFFAOYSA-N |