2-(2,3-dihydro-4H-1,4-benzothiazin-4-yl)-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(2,3-dihydro-4H-1,4-benzothiazin-4-yl)-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethan-1-one
2-(2,3-dihydro-4H-1,4-benzothiazin-4-yl)-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | G658-0028 |
| Compound Name: | 2-(2,3-dihydro-4H-1,4-benzothiazin-4-yl)-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 421.48 |
| Molecular Formula: | C21 H22 F3 N3 O S |
| Smiles: | C1CN(CCN1C(CN1CCSc2ccccc12)=O)c1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 3.6752 |
| logD: | 3.6752 |
| logSw: | -4.1363 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 22.454 |
| InChI Key: | ZPEHWSDLAJBYJL-UHFFFAOYSA-N |