6-(4-benzylpiperazine-1-carbonyl)-2-[(4-ethoxy-3-methoxyphenyl)methylidene]-4-methyl-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
6-(4-benzylpiperazine-1-carbonyl)-2-[(4-ethoxy-3-methoxyphenyl)methylidene]-4-methyl-2H-1,4-benzothiazin-3(4H)-one
6-(4-benzylpiperazine-1-carbonyl)-2-[(4-ethoxy-3-methoxyphenyl)methylidene]-4-methyl-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | K788-8461 |
| Compound Name: | 6-(4-benzylpiperazine-1-carbonyl)-2-[(4-ethoxy-3-methoxyphenyl)methylidene]-4-methyl-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 543.69 |
| Molecular Formula: | C31 H33 N3 O4 S |
| Smiles: | CCOc1ccc(\C=C2/C(N(C)c3cc(ccc3S2)C(N2CCN(CC2)Cc2ccccc2)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.9511 |
| logD: | 3.9357 |
| logSw: | -4.0513 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 50.136 |
| InChI Key: | JVRADJNFHAFXFN-UHFFFAOYSA-N |