4-methyl-2-[(3-methylphenyl)methylidene]-6-[4-(4-nitrophenyl)piperazine-1-carbonyl]-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
4-methyl-2-[(3-methylphenyl)methylidene]-6-[4-(4-nitrophenyl)piperazine-1-carbonyl]-2H-1,4-benzothiazin-3(4H)-one
4-methyl-2-[(3-methylphenyl)methylidene]-6-[4-(4-nitrophenyl)piperazine-1-carbonyl]-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | C310-2077 |
| Compound Name: | 4-methyl-2-[(3-methylphenyl)methylidene]-6-[4-(4-nitrophenyl)piperazine-1-carbonyl]-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 514.6 |
| Molecular Formula: | C28 H26 N4 O4 S |
| Smiles: | Cc1cccc(/C=C2/C(N(C)c3cc(ccc3S2)C(N2CCN(CC2)c2ccc(cc2)[N+]([O-])=O)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.8472 |
| logD: | 4.8472 |
| logSw: | -4.6189 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.397 |
| InChI Key: | WUKOJNBMOBXWBZ-UHFFFAOYSA-N |