5-[(pyridin-3-yl)methyl]-1-[3-(trifluoromethyl)phenyl]-1,3,5-triazinane-2-thione
Chemical Structure Depiction of
5-[(pyridin-3-yl)methyl]-1-[3-(trifluoromethyl)phenyl]-1,3,5-triazinane-2-thione
5-[(pyridin-3-yl)methyl]-1-[3-(trifluoromethyl)phenyl]-1,3,5-triazinane-2-thione
Compound characteristics
| Compound ID: | 8017-1130 |
| Compound Name: | 5-[(pyridin-3-yl)methyl]-1-[3-(trifluoromethyl)phenyl]-1,3,5-triazinane-2-thione |
| Molecular Weight: | 352.38 |
| Molecular Formula: | C16 H15 F3 N4 S |
| Smiles: | C(c1cccnc1)N1CNC(N(C1)c1cccc(c1)C(F)(F)F)=S |
| Stereo: | ACHIRAL |
| logP: | 3.0119 |
| logD: | 2.8877 |
| logSw: | -2.9669 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.4502 |
| InChI Key: | FOTQJVYQWSKDLJ-UHFFFAOYSA-N |