4-[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]-2-{[4-(trifluoromethyl)phenyl]methylidene}-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
4-[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]-2-{[4-(trifluoromethyl)phenyl]methylidene}-2H-1,4-benzothiazin-3(4H)-one
4-[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]-2-{[4-(trifluoromethyl)phenyl]methylidene}-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | K788-1987 |
| Compound Name: | 4-[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]-2-{[4-(trifluoromethyl)phenyl]methylidene}-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 529.62 |
| Molecular Formula: | C28 H30 F3 N3 O2 S |
| Smiles: | C1CCC(CC1)N1CCN(CC1)C(CN1C(/C(=C/c2ccc(cc2)C(F)(F)F)Sc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.509 |
| logD: | 5.3466 |
| logSw: | -5.7232 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 34.555 |
| InChI Key: | VHTSBFUHUDUWJQ-UHFFFAOYSA-N |