4-(3,5-dichloropyridin-2-yl)-N-[4-(trifluoromethoxy)phenyl]piperazine-1-carbothioamide
Chemical Structure Depiction of
4-(3,5-dichloropyridin-2-yl)-N-[4-(trifluoromethoxy)phenyl]piperazine-1-carbothioamide
4-(3,5-dichloropyridin-2-yl)-N-[4-(trifluoromethoxy)phenyl]piperazine-1-carbothioamide
Compound characteristics
| Compound ID: | 8013-5613 |
| Compound Name: | 4-(3,5-dichloropyridin-2-yl)-N-[4-(trifluoromethoxy)phenyl]piperazine-1-carbothioamide |
| Molecular Weight: | 451.3 |
| Molecular Formula: | C17 H15 Cl2 F3 N4 O S |
| Smiles: | C1CN(CCN1C(Nc1ccc(cc1)OC(F)(F)F)=S)c1c(cc(cn1)[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.0039 |
| logD: | 6.0039 |
| logSw: | -6.3644 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.4042 |
| InChI Key: | KMWJQSCYRUZYAS-UHFFFAOYSA-N |