6-(4-benzylpiperazine-1-carbonyl)-2-[(3,4-dimethoxyphenyl)methylidene]-4-methyl-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
6-(4-benzylpiperazine-1-carbonyl)-2-[(3,4-dimethoxyphenyl)methylidene]-4-methyl-2H-1,4-benzothiazin-3(4H)-one
6-(4-benzylpiperazine-1-carbonyl)-2-[(3,4-dimethoxyphenyl)methylidene]-4-methyl-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
Compound ID: | C310-2360 |
Compound Name: | 6-(4-benzylpiperazine-1-carbonyl)-2-[(3,4-dimethoxyphenyl)methylidene]-4-methyl-2H-1,4-benzothiazin-3(4H)-one |
Molecular Weight: | 529.66 |
Molecular Formula: | C30 H31 N3 O4 S |
Smiles: | CN1C(/C(=C/c2ccc(c(c2)OC)OC)Sc2ccc(cc12)C(N1CCN(CC1)Cc1ccccc1)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.6055 |
logD: | 3.5901 |
logSw: | -3.9218 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 50.556 |
InChI Key: | BQBSWFQFTLGHPF-UHFFFAOYSA-N |