2-[(3-chlorophenyl)methylidene]-4-methyl-6-(4-methylpiperazine-1-carbonyl)-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
2-[(3-chlorophenyl)methylidene]-4-methyl-6-(4-methylpiperazine-1-carbonyl)-2H-1,4-benzothiazin-3(4H)-one
2-[(3-chlorophenyl)methylidene]-4-methyl-6-(4-methylpiperazine-1-carbonyl)-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | C310-1565 |
| Compound Name: | 2-[(3-chlorophenyl)methylidene]-4-methyl-6-(4-methylpiperazine-1-carbonyl)-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 427.95 |
| Molecular Formula: | C22 H22 Cl N3 O2 S |
| Smiles: | CN1CCN(CC1)C(c1ccc2c(c1)N(C)C(/C(=C/c1cccc(c1)[Cl])S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0476 |
| logD: | 2.9169 |
| logSw: | -3.5596 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 35.232 |
| InChI Key: | XWTHNTDRBLRZBM-UHFFFAOYSA-N |