4-[2-oxo-2-(4-propylpiperazin-1-yl)ethyl]-2-{[4-(trifluoromethyl)phenyl]methylidene}-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
4-[2-oxo-2-(4-propylpiperazin-1-yl)ethyl]-2-{[4-(trifluoromethyl)phenyl]methylidene}-2H-1,4-benzothiazin-3(4H)-one
4-[2-oxo-2-(4-propylpiperazin-1-yl)ethyl]-2-{[4-(trifluoromethyl)phenyl]methylidene}-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | K788-2473 |
| Compound Name: | 4-[2-oxo-2-(4-propylpiperazin-1-yl)ethyl]-2-{[4-(trifluoromethyl)phenyl]methylidene}-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 489.56 |
| Molecular Formula: | C25 H26 F3 N3 O2 S |
| Smiles: | CCCN1CCN(CC1)C(CN1C(/C(=C/c2ccc(cc2)C(F)(F)F)Sc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4821 |
| logD: | 4.2996 |
| logSw: | -4.1543 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 35.252 |
| InChI Key: | ZOTYWVVKKMYPIT-UHFFFAOYSA-N |