4-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-2-[(2-fluorophenyl)methylidene]-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
4-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-2-[(2-fluorophenyl)methylidene]-2H-1,4-benzothiazin-3(4H)-one
4-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-2-[(2-fluorophenyl)methylidene]-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | C312-0524 |
| Compound Name: | 4-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-2-[(2-fluorophenyl)methylidene]-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 487.6 |
| Molecular Formula: | C28 H26 F N3 O2 S |
| Smiles: | C1CN(CCN1Cc1ccccc1)C(CN1C(/C(=C/c2ccccc2F)Sc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4915 |
| logD: | 4.476 |
| logSw: | -4.3317 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 35.002 |
| InChI Key: | KXCATQRUDXNMGA-UHFFFAOYSA-N |